Does a Molecule have the Same Conformation in the Crystalline State and in Solution? Comparison of NMR Results for the Solid State and Solution with those of the X‐ray Structural Determination

Horst Kessler; Gottfried Zimmermann; Hans Förster; Jürgen Engel; Gerhard Oepen; William S. Sheldrick

doi:10.1002/anie.198110531

Does a Molecule have the Same Conformation in the Crystalline State and in Solution? Comparison of NMR Results for the Solid State and Solution with those of the X‐ray Structural Determination

Horst Kessler
, Gottfried Zimmermann
, Hans Förster
, Jürgen Engel
, Gerhard Oepen
, William S. Sheldrick

Research output: Contribution to journal › Article › peer-review

63 Scopus citations

Abstract

The comparison of structures in the solid state and in solution by one method—NMR spectroscopy — enabled unequivocal demonstration of structural changes on dissolution of a solid compound. Thus,e.g., in the crystal the vinylogous amide (R = C₆H₁₁) investigated is E‐configurated at the CC double bond; in solution a Z‐form is most stable. (Figure Presented.)

Original language	English
Pages (from-to)	1053-1055
Number of pages	3
Journal	Angewandte Chemie International Edition in English
Volume	20
Issue number	12
DOIs	https://doi.org/10.1002/anie.198110531
State	Published - Dec 1981
Externally published	Yes

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Kessler, H., Zimmermann, G., Förster, H., Engel, J., Oepen, G., & Sheldrick, W. S. (1981). Does a Molecule have the Same Conformation in the Crystalline State and in Solution? Comparison of NMR Results for the Solid State and Solution with those of the X‐ray Structural Determination. Angewandte Chemie International Edition in English, 20(12), 1053-1055. https://doi.org/10.1002/anie.198110531

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title = "Does a Molecule have the Same Conformation in the Crystalline State and in Solution? Comparison of NMR Results for the Solid State and Solution with those of the X‐ray Structural Determination",

abstract = "The comparison of structures in the solid state and in solution by one method—NMR spectroscopy — enabled unequivocal demonstration of structural changes on dissolution of a solid compound. Thus,e.g., in the crystal the vinylogous amide (R = C6H11) investigated is E‐configurated at the CC double bond; in solution a Z‐form is most stable. (Figure Presented.)",

author = "Horst Kessler and Gottfried Zimmermann and Hans F{\"o}rster and J{\"u}rgen Engel and Gerhard Oepen and Sheldrick, \{William S.\}",

year = "1981",

month = dec,

doi = "10.1002/anie.198110531",

language = "English",

volume = "20",

pages = "1053--1055",

journal = "Angewandte Chemie International Edition in English",

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publisher = "John Wiley and Sons Ltd",

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Kessler, H, Zimmermann, G, Förster, H, Engel, J, Oepen, G & Sheldrick, WS 1981, 'Does a Molecule have the Same Conformation in the Crystalline State and in Solution? Comparison of NMR Results for the Solid State and Solution with those of the X‐ray Structural Determination', Angewandte Chemie International Edition in English, vol. 20, no. 12, pp. 1053-1055. https://doi.org/10.1002/anie.198110531

Does a Molecule have the Same Conformation in the Crystalline State and in Solution? Comparison of NMR Results for the Solid State and Solution with those of the X‐ray Structural Determination. / Kessler, Horst; Zimmermann, Gottfried; Förster, Hans et al.
In: Angewandte Chemie International Edition in English, Vol. 20, No. 12, 12.1981, p. 1053-1055.

Research output: Contribution to journal › Article › peer-review

TY - JOUR

T1 - Does a Molecule have the Same Conformation in the Crystalline State and in Solution? Comparison of NMR Results for the Solid State and Solution with those of the X‐ray Structural Determination

AU - Kessler, Horst

AU - Zimmermann, Gottfried

AU - Förster, Hans

AU - Engel, Jürgen

AU - Oepen, Gerhard

AU - Sheldrick, William S.

PY - 1981/12

Y1 - 1981/12

N2 - The comparison of structures in the solid state and in solution by one method—NMR spectroscopy — enabled unequivocal demonstration of structural changes on dissolution of a solid compound. Thus,e.g., in the crystal the vinylogous amide (R = C6H11) investigated is E‐configurated at the CC double bond; in solution a Z‐form is most stable. (Figure Presented.)

AB - The comparison of structures in the solid state and in solution by one method—NMR spectroscopy — enabled unequivocal demonstration of structural changes on dissolution of a solid compound. Thus,e.g., in the crystal the vinylogous amide (R = C6H11) investigated is E‐configurated at the CC double bond; in solution a Z‐form is most stable. (Figure Presented.)

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AN - SCOPUS:84985531967

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JO - Angewandte Chemie International Edition in English

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ER -

Kessler H, Zimmermann G, Förster H, Engel J, Oepen G, Sheldrick WS. Does a Molecule have the Same Conformation in the Crystalline State and in Solution? Comparison of NMR Results for the Solid State and Solution with those of the X‐ray Structural Determination. Angewandte Chemie International Edition in English. 1981 Dec;20(12):1053-1055. doi: 10.1002/anie.198110531

Does a Molecule have the Same Conformation in the Crystalline State and in Solution? Comparison of NMR Results for the Solid State and Solution with those of the X‐ray Structural Determination

Abstract

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