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(E)-N′-(5-Bromo-2-hydroxybenzylidene)-2-(4-isobutylphenyl)propanohydrazide
The title compound, C(20)H(23)BrN(2)O(2), containing an ibuprofen core, crystallizes with three independent molecules of similar conformation in the asymmetric unit. In these three molecules, the two benzene rings make dihedral angles of 82.7 (2), 71.2 (2) and 78.0 (3)° with respect to each other....
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/PMC3414297/ https://www.ncbi.nlm.nih.gov/pubmed/22904830 http://dx.doi.org/10.1107/S1600536812030322 |
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author | Mohamed, Shaaban K. Horton, Peter N. Akkurt, Mehmet Albayati, Mustafa R. Abdelhamid, Antar A. |
author_facet | Mohamed, Shaaban K. Horton, Peter N. Akkurt, Mehmet Albayati, Mustafa R. Abdelhamid, Antar A. |
author_sort | Mohamed, Shaaban K. |
collection | PubMed |
description | The title compound, C(20)H(23)BrN(2)O(2), containing an ibuprofen core, crystallizes with three independent molecules of similar conformation in the asymmetric unit. In these three molecules, the two benzene rings make dihedral angles of 82.7 (2), 71.2 (2) and 78.0 (3)° with respect to each other. The atoms of the isobutyl groups in two of the molecules are disordered over two positions, with site-occupancy ratios of 0.516 (8):0.484 (8) and 0.580 (8):0.420 (8). In the crystal, molecules are linked by N—H⋯O, C—H⋯O and O—H⋯N hydrogen bonds. Furthermore, C—H⋯π interactions are also observed. |
format | Online Article Text |
id | pubmed-3414297 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-34142972012-08-17 (E)-N′-(5-Bromo-2-hydroxybenzylidene)-2-(4-isobutylphenyl)propanohydrazide Mohamed, Shaaban K. Horton, Peter N. Akkurt, Mehmet Albayati, Mustafa R. Abdelhamid, Antar A. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(20)H(23)BrN(2)O(2), containing an ibuprofen core, crystallizes with three independent molecules of similar conformation in the asymmetric unit. In these three molecules, the two benzene rings make dihedral angles of 82.7 (2), 71.2 (2) and 78.0 (3)° with respect to each other. The atoms of the isobutyl groups in two of the molecules are disordered over two positions, with site-occupancy ratios of 0.516 (8):0.484 (8) and 0.580 (8):0.420 (8). In the crystal, molecules are linked by N—H⋯O, C—H⋯O and O—H⋯N hydrogen bonds. Furthermore, C—H⋯π interactions are also observed. International Union of Crystallography 2012-07-07 /pmc/articles/PMC3414297/ /pubmed/22904830 http://dx.doi.org/10.1107/S1600536812030322 Text en © Mohamed 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 Mohamed, Shaaban K. Horton, Peter N. Akkurt, Mehmet Albayati, Mustafa R. Abdelhamid, Antar A. (E)-N′-(5-Bromo-2-hydroxybenzylidene)-2-(4-isobutylphenyl)propanohydrazide |
title | (E)-N′-(5-Bromo-2-hydroxybenzylidene)-2-(4-isobutylphenyl)propanohydrazide |
title_full | (E)-N′-(5-Bromo-2-hydroxybenzylidene)-2-(4-isobutylphenyl)propanohydrazide |
title_fullStr | (E)-N′-(5-Bromo-2-hydroxybenzylidene)-2-(4-isobutylphenyl)propanohydrazide |
title_full_unstemmed | (E)-N′-(5-Bromo-2-hydroxybenzylidene)-2-(4-isobutylphenyl)propanohydrazide |
title_short | (E)-N′-(5-Bromo-2-hydroxybenzylidene)-2-(4-isobutylphenyl)propanohydrazide |
title_sort | (e)-n′-(5-bromo-2-hydroxybenzylidene)-2-(4-isobutylphenyl)propanohydrazide |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3414297/ https://www.ncbi.nlm.nih.gov/pubmed/22904830 http://dx.doi.org/10.1107/S1600536812030322 |
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