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7-Chloro-4-[(E)-N′-(4-fluorobenzylidene)hydrazinyl]quinoline monohydrate
The molecule of the title hydrate, C(16)H(11)ClFN(3)·H(2)O, is slightly twisted, as indicated by the dihedral angle of 9.55 (10)° formed between the quinoline ring system and the benzene ring. The conformation about the C=N double bond is E, and the amine-H atom is oriented towards the quinoline re...
Autores principales: | , , , , |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2009
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2980273/ https://www.ncbi.nlm.nih.gov/pubmed/21580042 http://dx.doi.org/10.1107/S1600536809053367 |
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author | de Souza, Marcus V. N. Howie, R. Alan Tiekink, Edward R. T. Wardell, James L. Wardell, Solange M. S. V. |
author_facet | de Souza, Marcus V. N. Howie, R. Alan Tiekink, Edward R. T. Wardell, James L. Wardell, Solange M. S. V. |
author_sort | de Souza, Marcus V. N. |
collection | PubMed |
description | The molecule of the title hydrate, C(16)H(11)ClFN(3)·H(2)O, is slightly twisted, as indicated by the dihedral angle of 9.55 (10)° formed between the quinoline ring system and the benzene ring. The conformation about the C=N double bond is E, and the amine-H atom is oriented towards the quinoline residue. In the crystal structure, the water molecule accepts an N—H⋯O and makes two O—H⋯N(quinoline) hydrogen bonds, generating a two-dimensional array in the ab plane, which is further stabilized by C—H⋯O interactions. The most significant contacts between layers are of the type C—H⋯F. |
format | Text |
id | pubmed-2980273 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2009 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29802732010-12-30 7-Chloro-4-[(E)-N′-(4-fluorobenzylidene)hydrazinyl]quinoline monohydrate de Souza, Marcus V. N. Howie, R. Alan Tiekink, Edward R. T. Wardell, James L. Wardell, Solange M. S. V. Acta Crystallogr Sect E Struct Rep Online Organic Papers The molecule of the title hydrate, C(16)H(11)ClFN(3)·H(2)O, is slightly twisted, as indicated by the dihedral angle of 9.55 (10)° formed between the quinoline ring system and the benzene ring. The conformation about the C=N double bond is E, and the amine-H atom is oriented towards the quinoline residue. In the crystal structure, the water molecule accepts an N—H⋯O and makes two O—H⋯N(quinoline) hydrogen bonds, generating a two-dimensional array in the ab plane, which is further stabilized by C—H⋯O interactions. The most significant contacts between layers are of the type C—H⋯F. International Union of Crystallography 2009-12-16 /pmc/articles/PMC2980273/ /pubmed/21580042 http://dx.doi.org/10.1107/S1600536809053367 Text en © Souza et al. 2010 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited. |
spellingShingle | Organic Papers de Souza, Marcus V. N. Howie, R. Alan Tiekink, Edward R. T. Wardell, James L. Wardell, Solange M. S. V. 7-Chloro-4-[(E)-N′-(4-fluorobenzylidene)hydrazinyl]quinoline monohydrate |
title | 7-Chloro-4-[(E)-N′-(4-fluorobenzylidene)hydrazinyl]quinoline monohydrate |
title_full | 7-Chloro-4-[(E)-N′-(4-fluorobenzylidene)hydrazinyl]quinoline monohydrate |
title_fullStr | 7-Chloro-4-[(E)-N′-(4-fluorobenzylidene)hydrazinyl]quinoline monohydrate |
title_full_unstemmed | 7-Chloro-4-[(E)-N′-(4-fluorobenzylidene)hydrazinyl]quinoline monohydrate |
title_short | 7-Chloro-4-[(E)-N′-(4-fluorobenzylidene)hydrazinyl]quinoline monohydrate |
title_sort | 7-chloro-4-[(e)-n′-(4-fluorobenzylidene)hydrazinyl]quinoline monohydrate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2980273/ https://www.ncbi.nlm.nih.gov/pubmed/21580042 http://dx.doi.org/10.1107/S1600536809053367 |
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