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N′-[(E)-2-Hydroxy-5-iodobenzylidene]furan-2-carbohydrazide monohydrate
The organic molecule of the title monohydrate, C(12)H(9)IN(2)O(3)·H(2)O, features a disordered furyl ring with the major component [site occupancy = 0.575 (18)] having the carbonyl O and furyl O atoms syn, and the other conformation having these atoms anti. The molecule is slightly twisted with th...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2012
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3275173/ https://www.ncbi.nlm.nih.gov/pubmed/22347029 http://dx.doi.org/10.1107/S1600536811055826 |
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author | Bikas, Rahman Anarjan, Parisa Mahboubi Ng, Seik Weng Tiekink, Edward R. T. |
author_facet | Bikas, Rahman Anarjan, Parisa Mahboubi Ng, Seik Weng Tiekink, Edward R. T. |
author_sort | Bikas, Rahman |
collection | PubMed |
description | The organic molecule of the title monohydrate, C(12)H(9)IN(2)O(3)·H(2)O, features a disordered furyl ring with the major component [site occupancy = 0.575 (18)] having the carbonyl O and furyl O atoms syn, and the other conformation having these atoms anti. The molecule is slightly twisted with the dihedral angle between the benzene and furyl rings being 10.3 (6)° (major component). An intramolecular O—H⋯N(imine) hydrogen bond is formed. In the crystal, the water molecule accepts a hydrogen bond from an amine H atom, and forms two O—H⋯O(carbonyl) hydrogen bonds, thereby linking three different carbohydrazide molecules. The result is a supramolecular layer parallel to (001). The closest contacts between layers are of the type I⋯I, at a distance of 3.6986 (6) Å. |
format | Online Article Text |
id | pubmed-3275173 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-32751732012-02-15 N′-[(E)-2-Hydroxy-5-iodobenzylidene]furan-2-carbohydrazide monohydrate Bikas, Rahman Anarjan, Parisa Mahboubi Ng, Seik Weng Tiekink, Edward R. T. Acta Crystallogr Sect E Struct Rep Online Organic Papers The organic molecule of the title monohydrate, C(12)H(9)IN(2)O(3)·H(2)O, features a disordered furyl ring with the major component [site occupancy = 0.575 (18)] having the carbonyl O and furyl O atoms syn, and the other conformation having these atoms anti. The molecule is slightly twisted with the dihedral angle between the benzene and furyl rings being 10.3 (6)° (major component). An intramolecular O—H⋯N(imine) hydrogen bond is formed. In the crystal, the water molecule accepts a hydrogen bond from an amine H atom, and forms two O—H⋯O(carbonyl) hydrogen bonds, thereby linking three different carbohydrazide molecules. The result is a supramolecular layer parallel to (001). The closest contacts between layers are of the type I⋯I, at a distance of 3.6986 (6) Å. International Union of Crystallography 2012-01-14 /pmc/articles/PMC3275173/ /pubmed/22347029 http://dx.doi.org/10.1107/S1600536811055826 Text en © Bikas et al. 2012 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 Bikas, Rahman Anarjan, Parisa Mahboubi Ng, Seik Weng Tiekink, Edward R. T. N′-[(E)-2-Hydroxy-5-iodobenzylidene]furan-2-carbohydrazide monohydrate |
title |
N′-[(E)-2-Hydroxy-5-iodobenzylidene]furan-2-carbohydrazide monohydrate |
title_full |
N′-[(E)-2-Hydroxy-5-iodobenzylidene]furan-2-carbohydrazide monohydrate |
title_fullStr |
N′-[(E)-2-Hydroxy-5-iodobenzylidene]furan-2-carbohydrazide monohydrate |
title_full_unstemmed |
N′-[(E)-2-Hydroxy-5-iodobenzylidene]furan-2-carbohydrazide monohydrate |
title_short |
N′-[(E)-2-Hydroxy-5-iodobenzylidene]furan-2-carbohydrazide monohydrate |
title_sort | n′-[(e)-2-hydroxy-5-iodobenzylidene]furan-2-carbohydrazide monohydrate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3275173/ https://www.ncbi.nlm.nih.gov/pubmed/22347029 http://dx.doi.org/10.1107/S1600536811055826 |
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