3. Publications by Jack Dunitz. 1947-2004.
Series 3 is comprised of reprints of scientific publications authored or co-authored by Jack Dunitz, as collected by Dunitz.
8 boxes
Boxes 3.001 - 3.008 (Page: 1 - 8)
3.001.
Publications by Jack Dunitz. 1947-1960. 33 folders
1.1.
The Crystal and Molecular Structure of Certain Dicarboxylic Acids.
Part I. Oxalic Acid Dihydrate.
J. Chem. Soc. (1947): 142-148. [J. D. Dunitz and J. M. Robertson].
1.2.
The Crystal and Molecular Structure of Certain Dicarboxylic Acids.
Part III. Diacetylenedicarboxylic Acid Dihydrate.
J. Chem. Soc. (1947): 1145-1156. [J. D. Dunitz and J. M. Robertson].
1.3.
Some Developments in Structural Chemistry.
Oxford Science 2, 1 (June 1948): 24-34. [J. D. Dunitz and S. C. Wallwork].
1.4.
Structure of Calciferol.
Nature 162 (1948): 608-609. [D. Crowfoot and J. D. Dunitz].
1.5.
The Structure of the Centrosymmetric Isomer of 1:2:3:4-Tetraphenylcyclobutane.
Acta Crystallogr. 2 (1949): 1-13.
1.6.
The Constitution of the Dimer of Acenaphthylene.
Acta Crystallogr. 2 (1949): 62. [J. D. Dunitz and L. Weissman].
1.7.
X-ray Structure Analysis of Complex Organic Compounds.
Research 3 (1950): 6-12.
1.8.
A Reinvestigation of the Structures of Chlorine Monoxide and Chlorine Dioxide by Electron
Diffraction.
J. Amer. Chem. Soc. 72 (1950): 3108-3112. [J. D. Dunitz and K. Hedberg].
1.9.
X-ray Analysis of some Antibiotic Substances.
J. Amer. Chem. Soc. 72 (1950): 4276. [J. D. Dunitz and J. E. Leonard].
1.10.
The Crystal Structure of Chloramphenicol and Bromamphenicol.
J. Amer. Chem. Soc. 74 (1952): 995-999.
1.11.
Purpurogallin: by X-ray Fourier Synthesis.
Nature 169 (1952): 1087.
1.12.
Influence of Chain Length on the Symmetry of Conjugated Molecules.
J. Chem. Phys. 20 (1952): 1328. [J. D. Dunitz and L. E. Orgel].
1.13.
Bis-cyclopentadienyl iron: a Molecular Sandwich.
Nature 171 (1953): 121-122. [J. D. Dunitz and L. E. Orgel].
1.14.
Crystallography.
Ann. Rep. Chem. Soc. for 1952 49 (1953): 343-381. [J. H. Robertson and J. D. Dunitz].
1.15.
Electronic Structure of Metal bis-cyclopentadienyls.
J. Chem. Phys. 23 (1955): 954-958. [J. D. Dunitz and L. E. Orgel].
1.16.
Structure of Dithionite.
J. Amer. Chem. Soc. 78 (1956): 878.
1.17.
The Crystal Structure of Ferrocene.
Acta Crystallogr. 9 (1956): 373-375. [J. D. Dunitz, L. E. Orgel and A. Rich].
1.18.
The Structure of Sodium Dithionite and the Nature of the Dithionite Ion.
Acta Crystallogr. 9 (1956): 579-586.
1.19.
Comments on a Method of Structure Determination.
Acta Crystallogr. 9 (1956): 537. [J. D. Dunitz and L. E. Orgel].
1.20.
Stereochemistry of Cupric Compounds.
Nature 179 (1957): 462-465. [L. E. Orgel and J. D. Dunitz].
1.21.
Electronic Properties of Transition-metal Oxides - I.
Distortions from Cubic Symmetry.
J. Phys. Chem. Solids 3 (1957): 20-29. [J. D. Dunitz and L. E. Orgel].
1.22.
Electronic Properties of Transition-metal Oxides - II.
Cation Distribution amongst Octahedral or Tetrahedral Sites.
J. Phys. Chem. Solids 3 (1957): 318-323. [J. D. Dunitz and L. E. Orgel].
1.23.
Structure of Calciferol.
Chemistry and Industry (1957): 1148-1149. [D. C. Hodgkin, M. S. Webster and J. D. Dunitz].
1.24.
Structure of the Cyclododecane Molecule.
Proc. Chem. Soc. (1958): 348-349 . [J. D. Dunitz and H. M. M. Shearer].
1.25.
The Crystal Structure of the Cuprous Chloride Azomethane Complex.
Acta Crystallogr. 13(1960): 28-34 . [I. D. Brown and J. D. Dunitz].
1.26.
Structure of the Cyclododecane Molecule: Amendment.
Proc. Chem. Soc. (1959): 268. [J. D. Dunitz and H. M. M. Shearer].
1.27.
Les Structures des Cycles de Taille Moyenne. I. Un Examen aux Rayons X de quelques
Sels de Cyclononylamine.
Helv. Chim. Acta 43 (1960): 1-2. [R. F. Bryan et J. D. Dunitz].
1.28.
Les Structures des Cycles de Taille Moyenne. II. La Structure Cristalline et Moléculaire
du Bromure de Cyclononylammonium.
Helv. Chim. Acta 43 (1960): 3-18. [R. F. Bryan et J. D. Dunitz].
1.29.
Die Strukturen der mittleren Ringverbindungen. III. Die Struktur des Cyclododecans.
Helv. Chim. Acta 43 (1960): 18-35. [J. D. Dunitz and H. M. M. Shearer].
1.30.
Strukturen der mittleren Ringverbindungen. IV. 1,6-trans-Diaminocyclodecandihydrochlorid,
trikline Modifikation.
Helv. Chim. Acta 43 (1960): 760-768. [E. Huber-Buser and J. D. Dunitz].
1.31.
The Crystal Structure of Diazoaminobenzene Copper (I).
Acta Crystallogr. 14 (1961): 480-485. [I. D. Brown and J. D. Dunitz].
1.32.
Röntgenographisch bestimmte Konformationen und Reaktivität mittlerer Ringe.
Angew. Chem. 72 (1960): 896-902. [J. D. Dunitz and V. Prelog].
1.33.
Struktur des Cycloheptatrien-molybdän-tricarbonyls, C7H8Mo(CO)3.
Helv. Chim. Acta 43 (1960): 2188-2197. [J. D. Dunitz and P. Pauling].
3.002.
Publications by Jack Dunitz. 1961-1966. 38 folders
2.1.
The Crystal Structure of Chromium (II) Chloride.
Acta Crystallogr. 14 (1961): 927-929. [J. W. Tracy, N. W. Gregory, E. C. Lingafelter, J. D. Dunitz,
H. -C. Mez, R. E. Rundle, C. Scheringer, H. L. Yakel, Jr. and M. K. Wilkinson].
2.2.
Kristallographische Daten für das vermutliche 1-Anilino-4-chlor-pyromellitsäure-di-phenylimid.
Helv. Chim. Acta 44 (1961): 442-444. [J. D. Dunitz, H.-C. Mez, H. Hopff and B. K. Manukian].
2.3.
Conformation of the Cyclodecane Ring.
Proc. Chem. Soc. (1961): 463. [E. Huber-Buser, J. D. Dunitz and K. Venkatesan].
2.4.
Die Strukturen der mittleren Ringverbindungen. V. 1,6-trans-Diaminocyclodecandihydrochlorid.
Helv. Chim. Acta 44 (1961): 2027-2033. [E. Huber-Buser and J. D. Dunitz].
2.5.
Die Strukturen der mittleren Ringverbindungen. VI. 1,6-cis-Diaminocyclodecan-dihydrochlorid.
Helv. Chim. Acta 44 (1961): 2033-2041. [J. D. Dunitz and K. Venkatesan].
2.6.
Stoffwechselprodukte von Actinomyceten. 32. Mitteilung.
Über die Konstitution von Nonactin.
Helv. Chim. Acta 45 (1962): 129-138. [J. Dominguez, J. D. Dunitz, H. Gerlach and V. Prelog].
2.7.
Kristallstruktur des Benzol-Addukts des 1, 2, 3, 4-Tetramethyl cyclobutadien-nickel
(II) - chlorids.
Helv. Chim. Acta 45 (1962): 647-665. [J. D. Dunitz, H. -C. Mez, O. S. Mills and H. M. M. Shearer].
2.8.
Nature of Orientational Defects in Ice.
Nature 197 (1963): 860-862.
2.9.
The crystal structure of aureomycin (chlortetracycline) hydrochloride.
Configuration, bond distances and conformation.
J. Amer. Chem. Soc. 85 (1963): 851-856. [J. Donohue, J. D. Dunitz, K. N. Trueblood and M. S. Webster].
2.10.
The Crystal Structure of a Calciferol Derivative.
J. Chem. Soc. (1963): 4945-4956. [D. C. Hodgkin, B. M. Rimmer, J. D. Dunitz and K. N. Trueblood].
2.11.
The Supposed Existence of two Molecular Forms in Crystals of Acetyl Choline Bromide.
Acta Chem. Scand. 17 (1963): 1471-1472.
2.12.
The Structure of Patchouli Alcohol.
Proc. Chem. Soc. (1963): 383. [M. Dobler, J. D. Dunitz, B. Gubler, H. P. Weber, G. Büchi and J. Padilla
O.].
2.13.
The Interpretation of Pseudo-orthorhombic Diffraction Patterns.
Acta Crystallogr. 17 (1964): 1299-1304.
2.14.
Die Konformation des Bicyclo [3.3.1]nonan-Systems. I. Strukturanalyse
des 3-Azabicyclo[3.3.1]nonan-hydrobromids.
Helv. Chim. Acta 47 (1964): 695-704. [M. Dobler and J. D. Dunitz].
2.15.
Die Strukturen der mittleren Ringverbindungen. VII. 1,6-trans-Dibromcyclodecan.
Helv. Chim. Acta 47 (1964): 951-956. [J. D. Dunitz and H. P. Weber].
2.16.
Die Strukturen der mittleren Ringverbindungen.VIII. Azacyclododecan-hydrochlorid.
Helv. Chim. Acta 47 (1964): 1138-1147. [J. D. Dunitz and H. P. Weber].
2.17.
The Crystal Structure of Silver Cyanate.
Acta Crystallogr. 18 (1965): 424-428. [D. Britton and J. D. Dunitz].
2.18.
Strukturbestimmung organischer Molekeln durch Röntgenanalyse.
Analytische Chemie 205 (1964): 134-148.
2.19.
Polymorphism in Anhydrous Cobalt Sulphate.
Acta Crystallogr. 18 (1965): 737-740. [J. D. Dunitz and P. Pauling].
2.20.
Die Konfiguration des physiologisch wirksamen 2-Chlor-9-(w-dimethylaminopropyliden)-thioxanthens.
Helv. Chim. Acta 47 (1964): 1897-1902. [J. D. Dunitz, H. Eser and P. Strickler].
2.21.
Strucktur des Hexarhodano-kobalt(II)-di-quecksilber(II)-Benzol-Komplexes.
Helv. Chim. Acta 47 (1964): 1889-1897. [R. Grønbaek and J. D. Dunitz].
2.22.
Dorothy Crowfoot Hodgkin, Nobel Prize 1964 in Chemistry.
Experientia 20 (1964): 710.
2.23.
Structure Analysis of Nickel (II)-1,8,8,13,13-pentamethyl-5-cyano-trans-corrin chloride.
Proc. Roy. Soc. A288 (1965): 324-330. [J. D. Dunitz and E. F. Meyer, Jr.].
2.24.
The Crystal Structure of Silver Fulminate.
Acta Crystallogr. 19 (1965): 662-668. [D. Britton and J. D. Dunitz].
2.25.
Pseudo-orthorhombic Diffraction Patterns and OD Structures.
Acta Crystallogr. 19 (1965): 471-472. [K. Dornberger-Schiff and J. D. Dunitz].
2.26.
The Crystal Structure of AgCN . 2AgNO3.
Acta Crystallogr. 19 (1965): 815-820. [D. Britton and J. D. Dunitz].
2.27.
Die Strukturen der mittleren Ringverbindungen. IX. 1,8-Diazacyclotetradecan-dihydrobromid.
Helv. Chim. Acta 48 (1965) 1441-1449. [J. D. Dunitz and E. F. Meyer, Jr.].
2.28.
Die Kristallstruktur von 1,4-trans-Diaminocyclohexan-dihydrochlorid.
Helv. Chim. Acta 48 (1965): 1450-1456. [J. D. Dunitz and P. Strickler].
2.29.
Die Kristallstruktur der 1,6-Methano-cyclodecapentaen-2-carbonsäure.
Helv. Chim. Acta 48 (1965): 1429-1440. [M. Dobler and J. D. Dunitz].
2.30.
Conformation of a Cyclo-octane Derivative.
Chem. Comm. (1966): 166. [J. D. Dunitz and A. Mugnoli].
2.31.
Refinement of the L-Alanine Crystal Structure.
Acta Crystallogr. 21 (1966): 617-618. [J. D. Dunitz and R. R. Ryan].
2.32.
Kristallographische Daten für Tris-isopropyliden-cyclopropan.
Helv. Chim. Acta 49 (1966): 1680. [J. D. Dunitz and A. Mugnoli].
2.33.
Preferred Rotational Conformation of Carboxyl Groups on the Cyclohexane Ring.
Tetrahedron Letters 33 (1966): 3933-3934. [J. D. Dunitz and P. Strickler].
2.34.
Die Strukturen der mittleren Ringverbindungen. X. 1,6-trans-Diaminocyclodecan-hydrochloride,
monokline Modifikation.
Helv. Chim. Acta 49 (1966): 1821-1827. [E. Huber-Buser and J. D. Dunitz].
2.35.
Verfeinerung der Kristallstruktur von 1,4-trans-Diaminocyclohexan-dihydrochlorid.
Helv. Chim. Acta 49 (1966): 2502-2505. [J. D. Dunitz and P. Strickler].
2.36.
Die Kristallstruktur von 1,4-trans-Cyclohexan-dicarbonsäure.
Helv. Chim. Acta 49 (1966): 2505-2515. [J. D. Dunitz and P. Strickler].
2.37.
Die Strukturen der mittleren Ringverbindungen. XI. Cyclooctan-1,2-trans-dicarbonsäure.
Helv. Chim. Acta 49 (1966): 2492-2502. [M. Dobler, J. D. Dunitz and A. Mugnoli].
2.38.
Isomerism in a Macrocyclic Schiff Base Nickel (II) Complex: Structure of the β-isomer.
Chem. Comm. (1966): 910. [R. R. Ryan, B. T. Kilbourn and J. D. Dunitz].
3.003.
Publications by Jack Dunitz. 1967-1974. 35 folders
3.1.
Preferred conformation of the carboxyl group.
In Structural Chemistry and Molecular Biology: A Volume Dedicated to Linus Pauling by
his Students, Colleagues, and Friends. Ed. A. Rich and N. Davidson. Freeman, 1968, pp. 595-602. [J. D. Dunitz and P. Strickler].
3.2.
Structural and Strain-energy Consequences of "Intra-annular" Substitution in the Cyclodecane
Ring.
Chem. Comm. (1967): 360. [M. Bixon, H. Dekker, J. D. Dunitz, H. Eser, S. Lifson, C. Mosselman,
J. Sicher and M. Svoboda].
3.3.
The Crystal and Molecular Structure of μ4-oxohexa-μ-chlorotetrakis (pyridine copper
(II)), Cu4Cl6O.4C5H5N, a Polynuclear Copper Complex.
Inorg. Chim. Acta 1 (1967): 209-216. [B. T. Kilbourn and J. D. Dunitz].
3.4.
Die Strukturen der mittleren Ringverbindungen. XII. Kristallstruktur der 1,1,5,5-Tetramethylcyclodecan-8-carbonsäure.
Helv. Chim. Acta 50 (1967) 1565-1572.[J. D. Dunitz and H. Eser].
3.5.
Die Strukturen der mittleren Ringverbindungen. XIII. Zwei neue Konformationen des
Cyclodecanringes.
Helv. Chim. Acta 50 (1967): 1572-1583. [J. D. Dunitz, H. Eser, M. Bixon and S. Lifson].
3.6.
Die Strukturen der mittleren Ringverbindungen. XIV. Struktur des Silbernitrat-trans-Cyclodecen-Addukts.
Helv. Chim. Acta 50 (1967): 2379-2386. [P. Ganis and J. D. Dunitz].
3.7.
Die Kristallstruktur des 1,6-8,13-Bis-oxido-[14]-annulens.
Helv. Chim. Acta 50 (1967): 2369-2378. [P. Ganis and J. D. Dunitz].
3.8.
Structure of the K+ Complex with Nonactin, a Macrotetrolide Antibiotic Possessing Highly Specific K+ Transport Properties.
J. Mol. Biology 30 (1967): 559-563. [B. T. Kilbourn, J. D. Dunitz, L. A. R. Pioda and W. Simon].
3.9.
Lattice Parameters and Space Groups of some Aromatic Schiff Bases.
Acta Crystallogr. B24 (1968): 463-464. [H. B. Bürgi, J. D. Dunitz and C. Züst].
3.10.
Die Strukturen der mittleren Ringverbindungen. XV. 6-Ketononanolid (Oxacyclodeca-2,7-dion).
Helv. Chim. Acta 51 (1968): 445-458. [W. Fedeli and J. D. Dunitz].
3.11.
Conformation of the Bicyclo[2,2,2]octane System.
Chem. Comm. (1968): 567-568. [O. Ermer and J. D. Dunitz].
3.12.
Umordnung von Liganden an trigonal bipyramidalen Atomen.
Angew. Chem. 80 (1968): 700-701. [J. D. Dunitz and V. Prelog].
English translation: Ligand Reorganization in the Trigonal Bipyramid. Angew. Chem. Int. Ed. Engl. 7, 725-726 (1968). [J. D. Dunitz and V. Prelog]
3.13.
Die Strukturen der mittleren Ringverbindungen. XVI. Cyclooctan-cis-1,2-dicarbonsäure.
Helv. Chim. Acta 51 (1968): 1514-1526. [H. B. Bürgi and J. D. Dunitz].
3.14.
Structure of the K+ Complex with Enniatin B, a Macrocyclic Antibiotic with K+ Transport Properties.
J. Mol. Biology 42 (1969): 603-606. [M. Dobler, J. D. Dunitz and J. Krajewski].
3.15.
Least-squares Refinement of Centrosymmetrical Trial Structures in Non-centrosymmetric
Space Groups. A Warning.
Acta Crystallogr. A26 (1970): 163. [O. Ermer and J. D. Dunitz].
3.16.
Molecular Conformation of Benzylideneanilines; Relation to Electronic Structure
and Spectra.
Chem. Comm. (1969): 472-473. [H. B. Bürgi and J. D. Dunitz].
3.17.
Langsame Inversion am pyramidal gebundenen Stickstoff: Kristallstrukturanalyse des
trans-N-Methoxy-3,3-dimethoxycarbonyl-5-cyan-1,2-oxazolidins.
Helv. Chim. Acta 52 (1969): 1831-1833. [M. Dobler, J. D. Dunitz and D. M. Hawley].
3.18.
Zur Konformation des Bicyclo[2.2.2]octan Systems.
Helv. Chim. Acta 52 (1969): 1861-1886. [O. Ermer and J. D. Dunitz].
3.19.
Die Struktur des KNCS-Komplexes von Nonactin.
Helv. Chim. Acta 52 (1969): 2573-2583. [M. Dobler, J. D. Dunitz and B. T. Kilbourn].
3.20.
Conformations of Medium Rings.
Pure and Applied Chemistry 25 (1971): 495-508.
3.21.
Conformations of Medium Rings.
Izvjestaj Jugoslav. centr. krist. 4 (1969): 37-47.
3.22.
The two Forms of Cyclohexane.
J. Chem. Ed. 47 (1970): 488-490.
3.23.
Multiple Solutions of Crystal Structures by Direct Methods.
Acta Crystallogr. A27 (1971): 117-119. [H. B. Bürgi and J. D. Dunitz].
3.24.
Experimental Determination of short Transannular H•••H Distances in a Cyclodecane
Derivative.
Chem. Comm. (1971): 178-179. [O. Ermer and J. D. Dunitz].
3.25.
Crystallographic Studies of Synthetic Corrinoids. I. Nickel (II)-1,8,8,13,13-pentamethyl-5-cyano-trans-corrin
Chloride.
Helv. Chim. Acta 54 (1971): 77-89. [J. D. Dunitz and E. F. Meyer, Jr.].
Crystallographic Studies of Synthetic Corrinoids. II. Molecular Structure of a C/D-seco-Corrinoid Nickel (II) Complex. Helv. Chim. Acta 54 (1971): 90-98. [M. Dobler and J. D. Dunitz].
Crystallographic Studies of Synthetic Corrinoids. III. Structural Similarities and Differences between A/D-seco-Corrinoid Complexes of Divalent Nickel, Palladium and Platinum. Helv. Chim. Acta 54 (1971): 98-112. [M. Currie and J. D. Dunitz].
Crystallographic Studies of Synthetic Corrinoids. II. Molecular Structure of a C/D-seco-Corrinoid Nickel (II) Complex. Helv. Chim. Acta 54 (1971): 90-98. [M. Dobler and J. D. Dunitz].
Crystallographic Studies of Synthetic Corrinoids. III. Structural Similarities and Differences between A/D-seco-Corrinoid Complexes of Divalent Nickel, Palladium and Platinum. Helv. Chim. Acta 54 (1971): 98-112. [M. Currie and J. D. Dunitz].
3.26.
The Non-planar Amide Group.
J. Mol. Biology 59 (1971): 169-182. [F. K. Winkler and J. D. Dunitz].
3.27.
Molecular Conformation of Benzylideneanilines.
Helv. Chim. Acta 54 (1971): 1255-1260. [H. B. Bürgi and J. D. Dunitz].
3.28.
Crystal Structure of the Antibiotic Monensin. Similarities and Differences between
Free Acid and Metal Complex.
Helv. Chim. Acta 54 (1971): 1103-1108. [W. K. Lutz, F. K. Winkler and J. D. Dunitz].
3.29.
The Planarity of the Equilateral, Isogonal Pentagon.
Elemente der Mathematik 27 (1972): 25-32. [J. D. Dunitz and J. Waser].
3.30.
Non-empirical SCF Calculations on Hydrogen-like Molecules: the Effect of Nuclear Charge
on Binding Energy and Bond Length.
Chem. Comm. (1972): 568-569. [J. D. Dunitz and T. K. Ha].
3.31.
Approximate Relationships between Conformational Parameters in 5- and 6-Membered Rings.
Tetrahedron 28 (1972): 5459-5467.
3.32.
Non-rigid-body Thermal-motion Analysis.
Acta Crystallogr. A29 (1973): 93-94. [J. D. Dunitz and D. N. J. White].
3.33.
A Complete Catalogue of Polyhedra with Eight or Fewer Vertices.
Acta Crystallogr. A29 (1973): 362-371. [D. Britton and J. D. Dunitz].
3.34.
Geometric Reaction Coordinates. II. Nucleophilic Addition to a Carbonyl Group.
J. Amer. Chem. Soc. 95 (1973): 5065-5067. [H. B. Bürgi, J. D. Dunitz and E. Shefter].
3.35.
Crystal Structure Analyses of 1,4,7,10,13,16-Hexaoxacyclooctadecane and its Complexes
with Alkali Thiocyanates.
Acta Crystallogr. B30 (1974): 2733-2738. [J. D. Dunitz, M. Dobler, P. Seiler and R. P. Phizackerley].
1,4,7,10,13,16-Hexaoxacyclooctadecane. Acta Crystallogr. B30 (1974): 2739-2741. [J. D. Dunitz and P. Seiler].
Hydrated Sodium Thiocyanate Complex of 1,4,7,10,13,16-Hexaoxacyclooctadecane Acta Crystallogr. B30 (1974): 2741-2743. [M. Dobler, J. D. Dunitz and P. Seiler].
Potassium Thiocyanate Complex of 1,4,7,10,13,16-Hexaoxacyclooctadecane. Acta Crystallogr. B30 (1974): 2744-2745. [P. Seiler, M. Dobler and J. D. Dunitz].
Calcium Thiocyanate Complex of 1,4,7,10,13,16-Hexaoxacyclooctadecane. Acta Crystallogr. B30 (1974): 2750. [J. D. Dunitz and P. Seiler].
1,4,7,10,13,16-Hexaoxacyclooctadecane. Acta Crystallogr. B30 (1974): 2739-2741. [J. D. Dunitz and P. Seiler].
Hydrated Sodium Thiocyanate Complex of 1,4,7,10,13,16-Hexaoxacyclooctadecane Acta Crystallogr. B30 (1974): 2741-2743. [M. Dobler, J. D. Dunitz and P. Seiler].
Potassium Thiocyanate Complex of 1,4,7,10,13,16-Hexaoxacyclooctadecane. Acta Crystallogr. B30 (1974): 2744-2745. [P. Seiler, M. Dobler and J. D. Dunitz].
Calcium Thiocyanate Complex of 1,4,7,10,13,16-Hexaoxacyclooctadecane. Acta Crystallogr. B30 (1974): 2750. [J. D. Dunitz and P. Seiler].
3.004.
Publications by Jack Dunitz. 1975-1978. 31 folders
4.1.
Non-bonded Interactions in Organic Molecules.
In International Review of Science: Physical Chemistry, Series 2, Volume 11. 1975, pp. 81-120. [J. D. Dunitz and H. B. Bürgi].
4.2.
Amide Group Deformation in Medium-ring Lactams.
Acta Crystallogr. B31 (1975): 251-263. [J. D. Dunitz and F. K. Winkler].
Medium-ring Compounds. XXVI. Tripelargolactam Oxonium Chloride. Acta Crystallogr. B31 (1975): 264-267. [F. K. Winkler and J. D. Dunitz].
Medium-ring Compounds. XIX. Caprolactam: Structure Refinement. Acta. Crystallogr. B31 (1975): 268-269. [F. K. Winkler and J. D. Dunitz].
Medium-ring Compounds. XX. Caprolactam Hydrochloride. Acta. Crystallogr. B31 (1975): 270-272. [ F. K. Winkler and J. D. Dunitz].
Medium-ring Compounds. XXI. Enantholactam Hydrochloride. Acta. Crystallogr. B31 (1975): 273-275. [F. K. Winkler and J. D. Dunitz].
Medium-ring Compounds. XXII. Caprylolactam. Acta. Crystallogr. B31 (1975): 276-278. [F. K. Winkler and J. D. Dunitz].
Medium-ring Compounds. XXIII. Caprylolactam Hydrochloride. Acta. Crystallogr. B31 (1975): 278-281. [F. K. Winkler and J. D. Dunitz].
Medium-ring Compounds. XXIV. Pelargolactam. Acta. Crystallogr. B31 (1975): 281-283. [F. K. Winkler and J. D. Dunitz].
Medium-ring Compounds. XXV. Pelargolactam Hemihydrochloride. Acta. Crystallogr. B31 (1975): 283-286. [F. K. Winkler and J. D. Dunitz].
Medium-ring Compounds. XXVII. Caprinolactam Hemihydrochloride. Acta. Crystallogr. B31 (1975): 286-288. [ F. K. Winkler and J. D. Dunitz].
Medium-ring Compounds. XXVI. Tripelargolactam Oxonium Chloride. Acta Crystallogr. B31 (1975): 264-267. [F. K. Winkler and J. D. Dunitz].
Medium-ring Compounds. XIX. Caprolactam: Structure Refinement. Acta. Crystallogr. B31 (1975): 268-269. [F. K. Winkler and J. D. Dunitz].
Medium-ring Compounds. XX. Caprolactam Hydrochloride. Acta. Crystallogr. B31 (1975): 270-272. [ F. K. Winkler and J. D. Dunitz].
Medium-ring Compounds. XXI. Enantholactam Hydrochloride. Acta. Crystallogr. B31 (1975): 273-275. [F. K. Winkler and J. D. Dunitz].
Medium-ring Compounds. XXII. Caprylolactam. Acta. Crystallogr. B31 (1975): 276-278. [F. K. Winkler and J. D. Dunitz].
Medium-ring Compounds. XXIII. Caprylolactam Hydrochloride. Acta. Crystallogr. B31 (1975): 278-281. [F. K. Winkler and J. D. Dunitz].
Medium-ring Compounds. XXIV. Pelargolactam. Acta. Crystallogr. B31 (1975): 281-283. [F. K. Winkler and J. D. Dunitz].
Medium-ring Compounds. XXV. Pelargolactam Hemihydrochloride. Acta. Crystallogr. B31 (1975): 283-286. [F. K. Winkler and J. D. Dunitz].
Medium-ring Compounds. XXVII. Caprinolactam Hemihydrochloride. Acta. Crystallogr. B31 (1975): 286-288. [ F. K. Winkler and J. D. Dunitz].
4.3.
Chemical Reaction Paths. V. The SN1 Reaction.
J. Amer. Chem. Soc. 97 (1975): 921-922. [P. Murray-Rust, H. B. Bürgi and J. D. Dunitz].
4.4.
On the Isomerization of Pentacoordinated Molecules.
J. Amer. Chem. Soc. 97 (1975): 3836. [D. Britton and J. D. Dunitz].
4.5.
Chemical Reaction Paths.
Phil. Trans. R. Soc. Lond. B272 (1975): 99-108.
4.6.
Medium ring Compounds. XXVIII. 1,5-Diaza-6,10-cyclodecadione.
Acta Crystallogr. B31 (1975): 1372-1377. [T. Srikrishnan and J. D. Dunitz].
4.7.
Comparison of the Results of Two Independent Analyses of the Ethylchlorophyllide A
Dihydrate Crystal Structure.
Acta Crystallogr. B31 (1975): 1586-1589. [C. Kratky and J. D. Dunitz].
4.8.
Structure of Hexaethylidenecyclohexane (hexamethyl-[6]radialene) by X-ray Analysis.
Helv. Chim. Acta 58 (1975): 707-712. [W. Marsh and J. D. Dunitz].
4.9.
Chemical Reaction Paths - VI. A Pericyclic Ring Closure.
Tetrahedron 31 (1975): 3089-3092. [H. B. Bürgi, E. Shefter and J. D. Dunitz].
4.10.
Incipient Nucleophilic Additions. I. 1-p-Tolyl-1-azacyclooctan-5-one.
Acta Crystallogr. B31 (1975): 2912-2914. [M. Kaftory and J. D. Dunitz].
Incipient Nucleophilic Additions. II. 11-Methyl-11-azabicyclo[5.3.1]undecan-4-one. Acta Crystallogr. B31 (1975): 2914-2916. [M. Kaftory and J. D. Dunitz].
Incipient Nucleophilic Additions. III. 3-Oxa-9-methyl-9-azabicyclo[3.3.1]nonan-7-one. Acta Crystallogr. B31 (1975): 2917-2918. [M. Kaftory and J. D. Dunitz].
Incipient Nucleophilic Additions. IV. 1,5-Dinitro-3-methyl-3-azabicyclo[3.3.1]nonan-7-one. Acta Crystallogr. B32 (1976): 1-4. [M. Kaftory and J. D. Dunitz].
Incipient Nucleophilic Additions. II. 11-Methyl-11-azabicyclo[5.3.1]undecan-4-one. Acta Crystallogr. B31 (1975): 2914-2916. [M. Kaftory and J. D. Dunitz].
Incipient Nucleophilic Additions. III. 3-Oxa-9-methyl-9-azabicyclo[3.3.1]nonan-7-one. Acta Crystallogr. B31 (1975): 2917-2918. [M. Kaftory and J. D. Dunitz].
Incipient Nucleophilic Additions. IV. 1,5-Dinitro-3-methyl-3-azabicyclo[3.3.1]nonan-7-one. Acta Crystallogr. B32 (1976): 1-4. [M. Kaftory and J. D. Dunitz].
4.11.
2,10,11-Trioxatricyclo[4,4,4,01,6]tetradecane: a Stable Orthoester.
Acta Crystallogr. B32 (1976): 318-320. [S. H. Banyard and J. D. Dunitz].
4.12.
11,13-Dioxo-12-methyl-12-aza[4,4,3]propella-3,8-diene.
Acta Crystallogr. B32 (1976): 617-619. [M. Kaftory and J. D. Dunitz].
4.13.
syn-8,9-epoxy-11,13-dioxo-12-methyl-12-aza[4,4,3]propell-3-ene.
Acta Crystallogr. B32 (1976): 619-622. [M. Kaftory, J. D. Dunitz and O. S. Mills].
4.14.
Versuche zur Redox-Simulation der photochemischen A/D-Secocorrin -> Corrin - Cycloisomerisierung.
Elektrochemische Oxidation von Nickel (II)-1-methyliden-2,2,7,7,12,12-hexamethyl-15-cyan-1,19-seco-corrinat-perchlorat.
Helv. Chim. Acta 59 (1976): 924-937. [B. Kräutler, A. Pfaltz, R. Nordmann, K. O. Hodgson, J. D. Dunitz
and A. Eschenmoser].
4.15.
Medium Ring Compounds. XXIX. Cyclooctane-1,5-dione-dioxime.
Helv. Chim. Acta 59 (1976): 1417-1423. [F. K. Winkler, P. Seiler, J. P. Chesick and J. D. Dunitz].
4.16.
Crystallographic Studies of Synthetic Corrinoids IV. Molecular Structure of a Ni(II)Oxaporphyrinoid.
From Electrochemical Oxidation of a Ni(II)Seco-Corrin.
Helv. Chim. Acta 59 (1976): 1898-1904. [K. O. Hodgson and J. D. Dunitz].
4.17.
Gerhard Schmidt (1919 - 1971) and the Road to Chemical Crystallography.
Monographs in Modern Chem. 8 (1976): 255-269.
4.18.
Ordered Aggregation Satates of Chlorophyll A and some Derivatives.
J. Mol. Biol. 113 (1977): 431-442. [C. Kratky and J. D. Dunitz].
4.19.
Methylchlorophyllide A Dihydrate.
Acta Crystallogr. B33 (1977): 545-547. [C. Kratky and J. D. Dunitz].
4.20.
Methylpyrochlorophyllide A Monohydrate Monoetherate.
Acta Crystallogr. B33 (1977): 547-549. [C. Kratky, H. P. Isenring and J. D. Dunitz].
4.21.
Directional Preferences of Nonbonded Atomic Contacts with Divalent Sulfur. I. Electrophiles
and Nucleophiles.
J. Amer. Chem. Soc. 99 (1977): 4860-4862. [Richard E. Rosenfield, Jr., R. Parthasarathy and J. D. Dunitz].
4.22.
1,4,9,12-Tetraoxadispiro[4.2.4.2]tetradecane.
Acta Crystallogr. B33 (1977): 1643-1645. [D. J. Chadwick, J. D. Dunitz and W. B. Schweizer].
4.23.
1-Carboxy-trans-bicyclo[4.4.0]decan-3-one Ethylene Acetal {trans-Hexahydrospiro [1,3-dioxolane-2,2'(1'H)-naphthalene]-8'a(3'H)-carboxylic
Acid}.
Acta Crystallogr. B34 (1978): 965-968. [D. J. Chadwick and J. D. Dunitz].
4.24.
Elimination of Extinction with a Temperature Gradient.
Acta Crystallogr. A34 (1978): 329-336. [P. Seiler and J. D. Dunitz].
4.25.
Distortions of MX4 Molecules from Td Symmetry; I. Kernel, Cokernel and Averaged Configurations.
Acta Crystallogr. B34 (1978): 1787-1793. [P. Murray-Rust, H. B. Bürgi and J. D. Dunitz].
4.26.
Distortions of MX4 Molecules from Td Symmetry; Analysis of PO4, SO4, and AlCl4 Species.
Acta Crystallogr. B34 (1978): 1793-1803. [P. Murray-Rust, H. B. Bürgi and J. D. Dunitz].
4.27.
A Test for Rigid-body Vibrations, based on a Generalization of Hirshfeld's "Rigid-Bond"
Postulate.
Acta Crystallogr. A34 (1978): 828-829. [R. E. Rosenfield, Jr., K. N. Trueblood and J. D. Dunitz].
4.28.
Regioselective, Stereoselective Reduction of gem-Disubstituted Succinimides: Steric
Hindrance along the Preferred Reaction Path.
Helv. Chim. Acta 61 (1978): 2176-2189. [R. E. Rosenfield. Jr. and J. D. Dunitz].
4.29.
Low-temperature Refinement of the Structure of 11-Methyl-11-azabicyclo[5.3.1] undecan-4-one.
Acta Crystallogr. B34 (1978): 3245-3248. [E. Bye and J. D. Dunitz].
4.30.
Nucleophilic Addition to a Triple Bond; Preliminary ab initio Study.
Helv. Chim. Acta 61 (1978): 2538-2541. [O. Eisenstein, G. Procter and J. D. Dunitz].
4.31.
Structural Studies of 1,8-Disubstituted Naphthalenes as Probes for Nucleophile - Electrophile
Interactions.
Helv. Chim. Acta 61 (1978): 2783-2808. [W. B. Schweizer, G. Procter, M. Kaftory and J. D. Dunitz].
3.005.
Publications by Jack Dunitz. 1979-1982. 33 folders
5.1.
Crystallographic and Spectroscopic Study of the Keto-acid-Hydroxy-lac-tone Isomerization
Path.
J. Chem. Soc. Perkin Transactions II (1979): 276-284. [D. J. Chadwick and J. D. Dunitz].
5.2.
A New Interpretation of the Disordered Crystal Structure of Ferrocene.
Acta Crystallogr. B35 (1979): 1068-1074. [P. Seiler and J. D. Dunitz].
5.3.
Description of Molecular Distortions in Terms of Symmetry Coordinates.
Acta Crystallogr. A35 (1979): 703-713. [P. Murray-Rust, H. B. Bürgi and J. D. Dunitz].
5.4.
The Structure of Triclinic Ferocene at 101, 123 and 148 K.
Acta Crystallogr. B35 (1979): 2020-2032. [P. Seiler and J. D. Dunitz].
5.5.
Crystal Structure of a Double Helicene, Diphenanthro-[4,3-a; 3',4'-o]Picene.
Bull. Soc. Chim. Belg. 88 (1979): 847-852. [W. Marsh and J. D. Dunitz].
5.6.
Kristallstruktur von 2-Lithium-2-methyl-1,3-dithian. TMEDA.
Angew.Chem. 92 (1980): 59-60. [R. Amstutz, D. Seebach, P. Seiler, B. Schweizer and J. D. Dunitz].
English translation: Crystal Structure of 2-Lithium-2-methyl-1,3-dithiane. TMEDA. Angew. Chem. Int. Ed. Engl. 19 (1980): 53-54. [R. Amstutz, D. Seebach, P. Seiler, B. Schweizer and J. D. Dunitz].
English translation: Crystal Structure of 2-Lithium-2-methyl-1,3-dithiane. TMEDA. Angew. Chem. Int. Ed. Engl. 19 (1980): 53-54. [R. Amstutz, D. Seebach, P. Seiler, B. Schweizer and J. D. Dunitz].
5.7.
1,4,7,10,13,16-Hexaoxacyclooctadecane: Crystal Structure at 100 K.
Acta Crystallogr. B36 (1980): 615-620. [E. Maverick, P. Seiler, W. B. Schweizer and J. D. Dunitz].
5.8.
Potential Energy Surface of BH4- and Molecular Deformations Induced by an External Cation.
Israel J. Chem. 19 (1980): 292-298. [O. Eisenstein and J. D. Dunitz].
5.9.
Synthesis, Properties, and Crystal Structure of Silylnitronates: Towards the SN2 Reaction Path with Retention of Configuration at Silicon.
Helv. Chim. Acta 63 (1980): 697-710. [E. W. Colvin, A. K. Beck, B. Bastani, D. Seebach, Y. Kai and
J. D. Dunitz].
5.10.
Directional Preferences of Approach of Nucleophiles to Sulfonium Ions.
Helv. Chim. Acta 63 (1980): 1068-1073. [D. Britton and J. D. Dunitz].
5.11.
Struktur eines O,N-Ketenacetals: (1RS, 8SR, 10SR, 4(15)Z)-4-Äthyliden-5-oxa-3-azatricyclo[8.4.0.03,8]tetradecan).
Helv. Chim. Acta 63 (1980): 1158-1175. [A. Kümin, E. Maverick, P. Seiler, N. Vanier, L. Damm, R. Hobi,
J. D. Dunitz and A. Eschenmoser].
5.12.
Redetermination of the Ruthenocene Structure at Room Temperature and at 101 K: Molecular
Internal Motion.
Acta Crystallogr. B36 (1980): 2946-2950. [P. Seiler and J. D. Dunitz].
5.13.
Planar tetrakoordiniertes Silicium? - Eine Kritik.
Angew. Chem. 92 (1980): 1070-1071.
English translation: Planar Four-Coordinates Silicon? Angew. Chem. Int. Ed. Engl. 19 (1980): 1034.
5.14.
Mapping Chemical Reaction Pathways: An Experimental Approach.
In Molecular Structure and Dynamics. Ed. M. Balaban. Internat. Science Services, 1980, pp. 103-128.
5.15.
Recognition and Use of Systematically Aberrant Phase Relationships.
Acta Crystallogr. A37 (1981): 131-132. [D. Britton and J. D. Dunitz].
5.16.
Crystal Structures of 8-Methoxy- and 8-Nitronaphthonitrile; Intramolecular Nucleophile-electrophile
Interactions.
Helv. Chim. Acta 64 (1981): 471-477. [G. Procter, D. Britton and J. D. Dunitz].
5.17.
Organic Chemistry, X-ray Analysis and Dorothy Hodgkin.
In Structural Studies on Molecules of Biological Interest, a Volume in Honour of Professor
Dorothy Hodgkin. Ed. G. Dodson, J. P. Glusker and D. Sayre. Oxford: Clarendon Press, 1981, pp. 47-59.
5.18.
Chemical Reaction Paths 7. Pathways for SN2 and SN3 Substitution at Sn(IV).
J. Amer. Chem. Soc. 103 (1981): 2971-2979. [D. Britton and J. D. Dunitz].
5.19.
Kristallstruktur von 2-Lithio-2-phenyl-1,3-dithian-Tetrahydrofuran-Tetramethyl-ethylendiamin
(1/1/1); "X - X" - Electronendichteverteilung in Lithio-methyl- und Lithio-phenyl-dithian.
Angew. Chem. 93 (1981): 487-488. [R. Amstutz, J. D. Dunitz and D. Seebach].
English translation: Crystal Structure of 2-Lithio-2-phenyl-1,3-dithiane-Tetrahydrofuran-Tetramethyl-ethylenediamine (1/1/1); Electron-Density Difference Maps for Lithio-methyl- and Lithio-phenyl-dithiane. Angew. Chem. Int. Ed. Engl. 20 (1981): 465-466. [R. Amstutz, J. D. Dunitz and D. Seebach].
English translation: Crystal Structure of 2-Lithio-2-phenyl-1,3-dithiane-Tetrahydrofuran-Tetramethyl-ethylenediamine (1/1/1); Electron-Density Difference Maps for Lithio-methyl- and Lithio-phenyl-dithiane. Angew. Chem. Int. Ed. Engl. 20 (1981): 465-466. [R. Amstutz, J. D. Dunitz and D. Seebach].
5.20.
Experimental Evidence for the Absence of Bonding Electron Density between Inverted
Carbon Atoms.
J. Amer. Chem. Soc. 103 (1981): 7378-7380. [P. Chakrabarti, P. Seiler, J. D. Dunitz, A. -D. Schlüter
and G. Szeimies].
5.21.
Correct Structure of a Condensation Product C6H12N4O4 from Hydrazine, Formaldehyde and Hydrogen Peroxide.
Helv. Chim. Acta 64 (1981): 2614-2616. [S. N. Whittleton, P. Seiler and J. D. Dunitz].
5.22.
Tetrameric Cubic Structures of Two Solvated Lithium Enolates.
Helv. Chim. Acta 64 (1981): 2617-2621. [R. Amstutz, W. B. Schweizer, D. Seebach and J. D. Dunitz].
5.23.
Mechanistic Implications of the Tetrameric Cubic Structure of Lithium Enolates.
Helv. Chim. Acta 64 (1981): 2622-2626. [D. Seebach, R. Amstutz and J. D. Dunitz].
5.24.
Crystallographic and Spectroscopic Evidence for an Intramolecular (OH•••π)-Interaction.
Helv. Chim. Acta 64 (1981): 2738-2740. [W. B. Schweizer, J. D. Dunitz, R. A. Pfund, G. M. Ramos Tombo
and C. Ganter].
5.25.
Structure, Synthesis, and Properties of Some Persubstituted 1,2-Dinitroethanes. In
Quest of Nitrocyclopropyl-Anion Derivatives.
Helv. Chim. Acta 65 (1982): 137-161. [Y. Kai, P. Knochel, S. Kwiatowski, J. D. Dunitz, J. F. M. Oth
and D. Seebach].
5.26.
Structure of 13-Methyl-2,1-dioxatricyclo[4.4.4.01,6]tetradecane at 96 K.
Acta Crystallogr. B38, 1241-1245 (1982). [K. L. Brown, G. J. Down, J. D. Dunitz and P. Seiler].
5.27.
Low-Temperature Crystallization of Orthorhombic Ferrocene: Structure Analysis at 98K.
Acta Crystallogr. B38 (1982): 1741-1745. [P. Seiler and J. D. Dunitz].
5.28.
4,5-Dimethyl-9,10-diazaphenanthrene N,N'-Dioxide.
Acta Crystallogr. B38 (1982): 2052-2053. [S. N. Whittleton and J. D. Dunitz].
5.29.
4,5-Dichloro-9,10-diazaphenanthrene N,N'-Dioxide.
Acta Crystallogr. B38 (1982): 2053-2055. [S. N. Whittleton and J. D. Dunitz].
5.30.
Temperature Dependence of Thermal Motion in Crystalline Naphthalene.
Acta. Crystallogr. B38 (1982): 2218-2228. [C. P. Brock and J. D. Dunitz].
5.31.
Directional Preferences of Ether O-Atoms towards Alkali and Alkaline Earth Cations.
Helv. Chim. Acta 65 (1982): 1482-1488. [P. Chakrabarti and J. D. Dunitz].
5.32.
Structural Characteristics of the Carboxylic Amide Group.
Helv. Chim. Acta 65 (1982): 1555-1562. [P. Chakrabarti and J. D. Dunitz].
5.33.
Chemical Reaction Paths. VIII. Stereoisomerization Path for Triphenylphosphine Oxide
and Related Molecules: Indirect Observation of the Structure of the Transition State.
J. Amer. Chem. Soc. 104 (1982): 5893-5898. [E. Bye, W. B. Schweizer and J. D. Dunitz].
3.006.
Publications by Jack Dunitz. 1983-1987. 37 folders
6.1.
Internal Molecular Motions in Crystals. The Estimation of Force Constants, Frequencies
and Barriers from Diffraction Data. A Feasibility Study.
Acta Cryst. B39 (1983): 120-133. [K. N. Trueblood and J. D. Dunitz].
6.2.
X-Ray Study of the Deformation Density in Tetrafluoroterephthalodinitrile: Weak Bonding
Density in the C, F-Bond.
Helv. Chim. Acta 66 (1983): 123-133. [J. D. Dunitz, W. B. Schweizer and P. Seiler].
6.3.
Crystal Structure of 1,1,4,4,-Tetrafluorocyclohexane at 95 K.
Helv. Chim. Acta 66 (1983): 134-137. [J. D. Dunitz, W. B. Schweizer and P. Seiler].
6.4.
From Crystal Statics to Chemical Dynamics.
Accounts of Chemical Research 16 (1983): 153-161. [H. B. Bürgi and J. D. Dunitz].
6.5.
An All-nitrogen Aromatic Ring System: Structural Study of 4-Dimethylaminophenylpentazole.
J. Chem. Soc., Chem. Comm. (1983): 910-911. [J. D. Wallis and J. D. Dunitz].
6.6.
The Absence of Bonding Electron Density in Certain Covalent Bonds as Revealed by X-ray
Analysis.
J. Amer. Chem. Soc. 105 (1983): 7056-7058. [J. D. Dunitz and P. Seiler].
6.7.
Electron Distributions and the Chemical Bond. (Book Review)
Angew. Chemie 95 (1983): 759.
Reprinted in Angew. Chemie Int. Ed. Engl., 23, 86 (1984)
6.8.
Interactions between Functional Groups. I. Crystal Structure of 2-Phenylethynyl-N,N-dimethylaniline
at 98 K: A Remarkably Short C-H•••C Distance.
Helv. Chim. Acta 67 (1984): 39-46. [J. D. Wallis and J. D. Dunitz].
6.9.
Further Investigation of the Nature of the C-Li Bond. Structures of a Phenylthiomethyllithium
Complex and of a Methylthiomethyllithium Complex.
Helv. Chim. Acta 67 (1984): 224-236. [R. Amstutz, T. Laube, W. B. Schweizer, D. Seebach and J. D.
Dunitz].
6.10.
Incipient Nucleophilic Attack on a Nitrogen-Nitrogen Triple Bond: Crystal Structure
of Quinoline-8-diazonium-1-oxide tetrafluroborate at 95 K.
J. Chem. Soc.: Chem. Comm. (1984): 671-672. [J. D. Wallis and J. D. Dunitz].
6.11.
Can X-ray Diffraction Distinguish between Protium and Deuterium Atoms?
Nature 309 (1984): 435-438. [P. Seiler, B. Martinoni and J. D. Dunitz].
6.12.
Parameter Refinement for Tetrafluoroterephthalonitrile at 98 K: Making the Best of
a Bad Job.
Acta Crystallogr. B40 (1984): 319-327. [P. Seiler, W. B. Schweizer and J. D. Dunitz].
6.13.
Interactions between Functional Groups. II. Structure of the 2-Dimethylaminobenzenediazonium
Cation: Retention of Planarity Despite Excessive Steric Crowding.
Helv. Chim. Acta 67 (1984): 1374-1378. [J. D. Wallis and J. D. Dunitz].
6.14.
Crystal and Molecular Structure of 1-Lithio-3,6-diethoxy-2,5-dimethyl-1,2-dihydropyrazine,
the Lithiated Bis-lactim Ether of the Diketopiperazine from Alanine.
J. Chem. Soc., Chem. Comm. (1984): 853-854. [D. Seebach, W. Bauer, J. Hansen, T. Laube, W. B. Schweizer and
J. D. Dunitz].
6.15.
Stereochimica. In Enciclopedia del Novecento, Volume VII. 1984, pp. 162-172.
6.16.
From Crystal Statics Towards Molecular Dynamics.
Trans. Amer. Cryst. Assn. 20 (1984): 1-13.
6.17.
Electron Density Distribution in the Organic Superconductor (TMTSF)2AsF6: Fact and Fancy.
Science 228 (1985): 353-354.
6.18.
Über die Wechselwirkung zwischen Lithium-Enolaten und sekundären Aminen in Lösung
und im Kristall.
Helv. Chim. Acta 68 (1985): 1373-1393. [T. Laube, J. D. Dunitz and D. Seebach].
6.19.
Detection of Radiation Damage in Organic Crystals.
Aust. J. Phys. 38 (1985): 405-411. [P. Seiler and J. D. Dunitz].
6.20.
Structures of Three Lithium Ester Enolates by X-ray Diffraction: Derivation of Reaction
Path for Cleavage into Ketene and Alcoholate.
J. Amer. Chem. Soc. 107 (1985): 5403-5409. [D. Seebach, R. Amstutz, T. Laube, W. B. Schweizer and J.
D. Dunitz].
6.21.
Internal Molecular Motion as Forerunner of a Phase Change Involving Conformational
Isomerization.
J. Amer. Chem. Soc. 107 (1985): 5535-5537. [Q. C. Yang, M. F. Richardson and J. D. Dunitz].
6.22.
Internal Molecular Motion of Triphenylphosphine Oxide: Analysis of Atomic Displacement
Parameters for Orthorhombic and Monoclinic Crystal Modifications at 100 and 150 K.
J. Amer. Chem. Soc. 107 (1985): 6964-6970. [C. P. Brock, W. B. Schweizer and J. D. Dunitz].
6.23.
X-ray Diffraction Study of 2-Aminopropenenitrile at 97 K.
Helv. Chim. Acta 68 (1985): 2093-2099. [P. Seiler and J. D. Dunitz].
6.24.
Lone-Pair Directionality in Hydrogen Bond Potential Functions for Molecular Mechanics
Calculations: The Inhibition of Human Carbonic Anhydrase II by Sulfonamides.
J. Amer. Chem. Soc. 107 (1985): 7653-7658. [A. Vedani and J. D. Dunitz].
6.25.
Chiral Metals? A Chiral Substrate for Organic Conductors and Superconductors.
Helv. Chim. Acta 69 (1986): 69-70. [J. D. Wallis, A. Karrer and J. D. Dunitz].
6.26.
Die Geometrie von Lithium-Komplexen mit koordinative gebundenen Carbonylverbindungen
und die Struktur eines Lithiumdienolates.
Chem. Ber. 119 (1986): 434-443. [R. Amstutz, J. D. Dunitz, T. Laube, W. B. Schweizer and D.
Seebach].
6.27.
Interactions between Functional Groups. III. The Structure of N,N-Dimethylamino-8-nitro-1-naphthaleneamine
in Seven Crystalline Environments.
Helv. Chim. Acta 69 (1986): 255-266. [M. Egli, J. D. Wallis and J. D. Dunitz].
6.28.
Are Ionic Solids Really Built of Ions? New Evidence from X-ray Diffraction.
Helv. Chim. Acta 69 (1986): 1107-1112. [P. Seiler and J. D. Dunitz].
6.29.
Body Temperature and the Specific Heat of Water.
Nature 324 (1986): 418. [J. D. Dunitz and S. A. Benner].
6.30.
An Empirical Potential Function for Metal Centers: Application to Molecular Mechanics
Calculations on Metalloproteins.
J. Comput. Chem. 6 (1986): 701-710. [A. Vedani, M. Dobler and J. D. Dunitz].
6.31.
β-Propiolactam (1-Aza-2-cyclobutanone) at 170 K.
Acta Crystallogr. C43 (1987): 565-567. [Q. C. Yang, P. Seiler and J. D. Dunitz].
6.32.
Fractional Bonds: Relations among Their Lengths, Strengths and Stretching Force Constants.
J. Amer. Chem. Soc. 108 (1987): 2924-2926. [H. B. Bürgi and J. D. Dunitz].
6.33.
Are (TSeT)2I Crystals Homochiral or Microtwinned?
Acta Crystallogr. A43 (1987): 430-431. [A. Karrer and J. D. Dunitz].
6.34.
Structures and Electrical Properties of some New Organic Conductors Derived from the
Donor Molecule TMET (S,S,S,S-Bis(dimethylethylenedithio)tetrathiafulvalene.
Helv. Chim. Acta 70 (1987): 942-953. [A. Karrer, J. D. Wallis, J. D. Dunitz, B. Hilti, C. W. Mayer,
M. Bürkle and J. Pfeiffer].
6.35.
Eine Csp3-gebundene Methylgruppe in ekliptischer Konformation; experimenteller und theoretischer
Nachweis von C-H•••O Wasserstoffbrücken.
Angew. Chem. 99 (1987): 1216-1218. [P. Seiler, G. R. Weisman, E. D. Glendening, F. Weinhold, V.
B. Johnson and J. D. Dunitz].
English translation: Observation of an Eclipsed Csp3-CH3 Bond in a Tricyclic orthoamide; Experimental and Theoretical Evidence for C-H•••O Hydrogen Bonds. Angew. Chem. Int. Ed. Engl. 26 (1987): 1175-1177. [P. Seiler, G. R. Weisman, E. D. Glendening, F. Weinhold, V. B. Johnson and J. D. Dunitz].
English translation: Observation of an Eclipsed Csp3-CH3 Bond in a Tricyclic orthoamide; Experimental and Theoretical Evidence for C-H•••O Hydrogen Bonds. Angew. Chem. Int. Ed. Engl. 26 (1987): 1175-1177. [P. Seiler, G. R. Weisman, E. D. Glendening, F. Weinhold, V. B. Johnson and J. D. Dunitz].
6.36.
Rotation Barriers in Crystals from Atomic Displacement Parameters.
Molecular Physics 62 (1987): 451-459. [E. Maverick and J. D. Dunitz].
6.37.
Electron Density Maps.
In Patterson and Pattersons. Ed. J. P. Glusker, B. K. Patterson and M. Rossi. Oxford Univ. Press, 1987, pp. 222-251.
3.007.
Publications by Jack Dunitz. 1988-1995. 29 folders
7.1.
Is Accurate X-Ray Analysis Worthwhile?
Bull. Chem. Soc. Jpn. 61 (1988): 1-11.
7.2.
Interpretation of Atomic Displacement Parameters from Diffraction Studies.
J. Phys. Chem. 92 (1988): 856-867. [J. D. Dunitz, V. Schomaker and K. N. Trueblood].
7.3.
Gleichgewichtsstruktur, stabilisierter Uebergangszustand oder Fehlordnung im Kristall?
Tieftemperatur-Kristallstukturanalysen der antiaromatischen Systeme Tetra-tert-butyl-s-indacen
und Tetra-tert-butylcyclobutadien.
Angew. Chem. 100 (1988): 415-418. [J. D. Dunitz, C. Krüger, H. Irngartinger, E. F. Maverick, Y.
Wang and M. Nixdorf].
English translation: Equilibrium Structure, Stabilized Transition State, or Disorder in the Crystal? Studies of the Antiaromatic Systems Tetra-tert-butyl-s-indacene and Tetra-tert-butyl-cyclobutadiene by Low-Temperature Crystal Structure Analysis. Angew. Chem. Int. Ed. Engl. 27 (1988): 387-389. [J. D. Dunitz, C. Krüger, H. Irngartinger, E. F. Maverick, Y. Wang and M. Nixdorf].
7.4.
The Interpretation of Atomic Displacement Parameters.
Mol. Cryst. Liq. Cryst. Inc. Nonlin. Opt. 156 (1988): 11-24.
7.5.
A Pseudo-centrosymmetric Chiral Crystal Structure: (5S,6S)-5,6-Dihydro-5,6-dimethyl-1,3-dithiolo[4,5-b][1,4]dithiin-2-thione.
Acta Crystallogr. C44 (1988): 1037-1039. [J. D. Wallis and J. D. Dunitz].
7.6.
Electron Density Distributions in Covalent and Ionic Bonds.
In Molecular Structure: Chemical Reactivity and Biological Activity. Ed. J. J. Stezowski, J.-L. Huang and M.-C. Shao. Oxford Univ. Press, 1988, pp.242-248.
7.7.
Atombewegungen in Molekülkristallen aus Beugungsmessungen.
Angew. Chem. 100 (1988): 910-926. [J. D. Dunitz, E. F. Maverick and K. N. Trueblood].
Atomic Motions in Molecular Crystals from Diffraction Measurements. Angew. Chem. Int. Ed. Engl. 27 (1988): 880-895. [J. D. Dunitz, E. F. Maverick and K. N. Trueblood].
7.8.
Crystal Structures of Two Simple N-Substituted Dihydronicotinamides: Possible Implications
for Stereoelectronic Arguments in Enzymology.
J. Amer. Chem. Soc. 110 (1988): 5152-5157. [A. Glasfeld, P. Zbinden, M. Dobler, S. A. Benner and J. D.
Dunitz].
7.9.
Can Statistical Analysis of Structural Parameters from Different Crystal Structures
Lead to Quantitative Energy Relationships?
Acta Crystallogr. B44 (1988): 445-448. [H. B. Bürgi and J. D. Dunitz].
7.10.
Conformational Polymorphism of Dimethyl 3,6-Dichloro-2,5-dihydroxyterephthalate. I.
Structures and Atomic Displacement Parameters between 100 and 350 K for Three Crystal
Forms.
Acta Crystallogr. B45 (1989): 312-323. [Q. C. Yang, M. F. Richardson and J. D. Dunitz].
7.11.
An Eclipsed C(sp3)-CH3 Bond in a Crystalline Hydrated Tricyclic Orthoamide: Evidence for C-H•••O Hydrogen
Bonds.
Helv. Chem. Acta 72 (1989): 1125-1135. [P. Seiler and J. D. Dunitz].
7.12.
Medium-Ring Compounds. 30. cis-1,6-Cyclodecanediol: Molecular Compounds with the trans
Isomer and with Itself.
Israel J. Chem. 29 (1989): 137-142. [O. Ermer, B. R. Vincent and J. D. Dunitz].
7.13.
Calculated Reaction Paths for a Solid-State Reaction: Racemization of Chiral Crystalline
Cobaloxime Complexes by Exposure to X-Rays.
Acta Crystallogr. B46 (1990): 45-54. [A. Uchida and J. D. Dunitz].
7.14.
Distance Geometry and Molecular Conformation. (Book Review)
J. Comp. Chem. 11 (1990): 265-266.
7.15.
How Good Are Quartic Functions to Describe Double-Minimum Energy Profiles? Nitrogen
Inversion as Example.
Helv. Chim. Acta 73 (1990): 583-593. [T. K. Ha and J. D. Dunitz].
7.16.
Stereoelectronic Aspects of the Anomeric Effect in Fluoromethylamine.
Helv. Chim. Acta 73 (1990): 1805-1817. [J. J. Irwin, T. K. Ha and J. D. Dunitz].
7.17.
Phase Transitions in Molecular Crystals from a Chemical Viewpoint.
Pure & Appl. Chem. 63 (1991): 177-185.
7.18.
Accurate Molecular Structures, their Determination and Importance. (Book Review)
Acta Crystallographica B49 (1993): 145-146.
7.19.
Structural Chemistry in Helvetica Chimica Acta 1917-1992.
Helv. Chim. Acta 76 (1993): 1115-1166. [H. B. Bürgi and J. D. Dunitz].
7.20.
Interactions between Functional Groups. Part IV. The Responses of Four Diazonium Groups
to Adjacent Electron-Rich Atoms in Peri-Substituted Naphthalene and Quinoline Derivatives.
Helv. Chim. Acta 76 (1993): 1411-1424. [J. D. Wallis, R. J. C. Easton and J. D. Dunitz].
7.21.
A. I. Kitaigorodsky: Personal Reminiscences.
Acta Chemica Hungarica - Models in Chemistry 130 (1993): 153-157.
7.22.
Forty years of Ferrocene.
In Organic Chemistry: Its Language and Its State of the Art. Ed. M. V. Kisakürek.
Basel: Verlag HCA, 1993, pp. 9-24.
7.23.
The Entropic Cost of Bound Water in Crystals and Biomolecules.
Science 264 (1994): 670.
7.24.
Disappearing Polymorphs.
Acc. Chem. Res. 28 (1995): 193-200.
7.25.
Right and Left in Chiral Crystals.
Acta Crystallographica A51 (1995): 588.
7.26.
Phase Changes and Chemical Reactions in Molecular Crystals.
Acta Crystallographica B51 (1995): 619-631.
7.27.
Anhydrous DL-Glutamic Acid.
Acta Crystallographica C51 (1995): 1377-1379.
7.28.
Scientific research - panacea or Pandora's Box.
European Review 3 (1995): 295-301.
7.29.
Win some, lose some: enthalpy-entropy compensation in weak intermolecular interactions.
Chemistry and Biology 2 (1995): 709-712.
3.008.
Publications by Jack Dunitz. 1996-2004. 31 folders
8.1.
Thoughts on Crystals as Supermolecules.
In The Crystal as a Supramolecular Entity. Ed. G. R. Desiraju.
John Wiley & Sons, 1996, pp. 1-30.
8.2.
A New Textual Analysis of the Prelog Erlkönig Legent; an Interdisciplinary Approach to Scientific History and Literary
Criticism.
Croatica Chemica Acta 69 (1996): 409-415. [E. Heilbronner and J. D. Dunitz].
Reprinted in Helvetica Chimica Acta 79 (1996): 1241-1248.
8.3.
Force of nature: The life of Linus Pauling. (Book review)
Protein Science 5 (1996): 2136-2138.
8.4.
Atomic Displacement Parameters Nomenclature: Report of a Subcommittee on Atomic Displacement
Parameter Nomenclature.
Acta Cryst. A52 (1996): 770-781. [K. N. Trueblood, H. B. Bürgi, H. Burzlaff, J. D. Dunitz, C.
M. Grammacioli, H. H. Schulz, U. Shmueli and S. C. Abrahams].
8.5.
Even-odd carbon atom disparity.
Nature (Lond.) 384 (1996): 320. [J. A. R. P. Sarma, A. Nangla, G. R. Desiraju, E. Zass and J. D.
Dunitz].
8.6.
Symmetry Arguments in Chemistry.
Proc. Natl. Acad. Sc. USA 93 (1996): 14260-14266.
8.7.
Dorothy Crowfoot Hodgkin - an introduction to her work and personality.
In The Collected Works of Dorothy Crowfoot Hodgkin.
Bangalore: Indian Institute of Sciences, 1996, pp vii-x.
Reprinted in Current Science 72 (1997): 447.
8.8.
Letter to the Editor. International Union of Crystallography Newsletter, 4, 3 (1996): 4.
8.9.
Organic Fluorine Hardly Ever Accepts Hydrogen Bonds.
Chem. Eur. J. 3 (1997): 83. [J. D. Dunitz and R. Taylor].
8.10.
Chemical Crystallography - Past, present and future.
Current Science 72 (1997): 468.
8.11.
Recollections of pre-prebiotic Leslie Orgel.
Orig. Life Evol. Biosphere 27 (1997): 421.
8.12.
Vladimir Prelog (1906-1998): Pioneer of Stereochemistry.
Nature, Lond. 391 (1998): 542.
8.13.
A Supramolecular Three-Dimensional Hydrogen-Bonded Network with Potential Application
in Crystal Engineering Paradigms.
Chem. Eur. J. 4 (1998): 745.
8.14.
Sum of Bond Angles on C Atoms.
Chemical Intelligencer 6 (1998): 53.
8.15.
New Light on an Old Story: The Solid-State Transformation of Ammonium Cyanate into
Urea.
J. Am. Chem. Soc. 120, 50 (1998): 13274-13275. [J. D. Dunitz, K. D. M. Harris, R. L. Johnston, B. M.
Kariuki, E. J. MacLean, K. Psallidas, W. B. Schweizer and R. R. Tykwinski].
8.16.
Introductory and Concluding Remarks to a Symposium "Are Crystal Structures Predictable?"
Nova Acta Leopoldina NF 79, Nr. 310 (1999): 9, 103-105.
8.17.
Into the New Millennium: the Present and Future of Crystal Structure Analysis.
In Implications of Molecular and Materials Structure for New Technologies. Ed. J. A. K. Howard, F. H. Allen and G. P. Shields. Dordrecht, Kluwer Academic Publishers,
1999, pp. 1-9.
8.18.
Weak Interactions in Molecular Crystals.
In Implications of Molecular and Materials Structure for New Technologies. Ed. J. A. K. Howard, F. H. Allen and G. P. Shields. Dordrecht: Kluwer Academic Publishers,
1999, pp. 175-184.
8.19.
Attractions and Repulsions in Molecular Crystals: What can be Learned from the Crystal
Structures of Condensed Ring Aromatic Compounds?
Acc. Chem. Res. 32 (1999): 677-684. [J. D. Dunitz and Angelo Gavezzotti].
8.20.
The self-made tapestry: Pattern formation in nature. (Book review)
Acta Cryst. B55 (1999): 810.
8.21.
A curiously short carbon-carbon double bond?
Chem. Comm. (1999): 2547.
8.22.
Don't get your helix in a twist. Chemistry in Britain (July 2000): 22.
8.23.
The Even/Odd Disparity in Organic Compounds.
Helv. Chim. Acta 83 (2000): 1-15. [G. R. Desiraju, J. D. Dunitz, A. Nangia, J. A. R. P. Sarma and
E. Zass].
8.24.
Space Filling in Molecular Solids.
In Space or Spaces as Paradigms of Mental Categories: Proceedings of the VIII International
Conference. Milan: Fondazione Carlo Erba, 2002, pp. 101-119.
8.25.
A test of crystal structure prediction of small organic molecules.
Acta Cryst. B56 (2000): 697-714. [J. P. M. Lommerse, W. D. S. Motherwell, H. L. Ammon, J. D.
Dunitz, A. Gavezzotti, D. W. M. Hofmann, F. J. J. Leusen, W. T. M. Mooij, S. L. Price,
B. Schweizer, M. U. Schmidt, B. P. van Eijck, P. Verwer and D. E. Williams].
8.26.
A Statistical Study of Density and Packing Variations among Crystalline Isomers.
Tetrahedron 56 (2000): 6595-6601. [J. D. Dunitz. G. Filippini and A. Gavezzotti].
8.27.
Molecular Shape and Crystal Packing: a Study of C12H12 Isomers, Real and Imaginary.
Helv. Chim. Acta 83 (2000): 2317-2335. [J. D. Dunitz. G. Filippini and A. Gavezzotti].
8.28.
Space filling in molecular crystals.
In Symmetry 2000. I. Hargittai and T. C. Laurent, eds. Wenner-Gren International Series, Vol. 80.
London: Portland Press, 2002, pp. 161-172.
8.29.
Crystallography: a Great Past, an Uncertain Future.
Z. Kristallographie 217 (2002): 299-300.
8.30.
Molecular Shape and Intermolecular Liaison: Hydrocarbons and Fluorocarbons.
Helv. Chem. Act. 86 (2003): 4073-4092.
8.31.
Organic Fluorine: Odd Man Out.
ChemBioChem 5 (2004): 614-621.
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4. Manuscripts and Lecture Materials.
4. Manuscripts and Lecture Materials.