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4-Chloro-N-(2,6-dimethyl­phen­yl)benzamide

The conformations of the N—H and C=O bonds in the structure of the title compound (N26DMP4CBA), C(15)H(14)ClNO, are anti to each other, similar to that observed in N-phenyl­benzamide, N-(3,4-dimethyl­phen­yl)benzamide, N-(2,6-dichloro­phen­yl)benzamide and other benzanilides. There are three mol­ecu...

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Autores principales: Gowda, B. Thimme, Tokarčík, Miroslav, Kožíšek, Jozef, Sowmya, B. P., Fuess, Hartmut
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961789/
https://www.ncbi.nlm.nih.gov/pubmed/21202983
http://dx.doi.org/10.1107/S1600536808019120
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author Gowda, B. Thimme
Tokarčík, Miroslav
Kožíšek, Jozef
Sowmya, B. P.
Fuess, Hartmut
author_facet Gowda, B. Thimme
Tokarčík, Miroslav
Kožíšek, Jozef
Sowmya, B. P.
Fuess, Hartmut
author_sort Gowda, B. Thimme
collection PubMed
description The conformations of the N—H and C=O bonds in the structure of the title compound (N26DMP4CBA), C(15)H(14)ClNO, are anti to each other, similar to that observed in N-phenyl­benzamide, N-(3,4-dimethyl­phen­yl)benzamide, N-(2,6-dichloro­phen­yl)benzamide and other benzanilides. There are three mol­ecules in the asymmetric unit of N26DMP4CBA. The central amide group is tilted with respect to the benzoyl ring by 45.2 (1)° in mol­ecule 1, 21.2 (2)° in mol­ecule 2 and 14.9 (2)° in mol­ecule 3. The dihedral angles between the benzoyl and aniline rings are 39.9 (1), 51.0 (1) and 86.3 (3)° in mol­ecules 1, 2 and 3, respectively. Inter­molecular N—H⋯O hydrogen bonds link the mol­ecules into infinite chains running along the [101] direction. One xylyl group is disordered over two positions; the site occupancy factors are ca 0.6 and 0.4.
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spelling pubmed-29617892010-12-30 4-Chloro-N-(2,6-dimethyl­phen­yl)benzamide Gowda, B. Thimme Tokarčík, Miroslav Kožíšek, Jozef Sowmya, B. P. Fuess, Hartmut Acta Crystallogr Sect E Struct Rep Online Organic Papers The conformations of the N—H and C=O bonds in the structure of the title compound (N26DMP4CBA), C(15)H(14)ClNO, are anti to each other, similar to that observed in N-phenyl­benzamide, N-(3,4-dimethyl­phen­yl)benzamide, N-(2,6-dichloro­phen­yl)benzamide and other benzanilides. There are three mol­ecules in the asymmetric unit of N26DMP4CBA. The central amide group is tilted with respect to the benzoyl ring by 45.2 (1)° in mol­ecule 1, 21.2 (2)° in mol­ecule 2 and 14.9 (2)° in mol­ecule 3. The dihedral angles between the benzoyl and aniline rings are 39.9 (1), 51.0 (1) and 86.3 (3)° in mol­ecules 1, 2 and 3, respectively. Inter­molecular N—H⋯O hydrogen bonds link the mol­ecules into infinite chains running along the [101] direction. One xylyl group is disordered over two positions; the site occupancy factors are ca 0.6 and 0.4. International Union of Crystallography 2008-06-28 /pmc/articles/PMC2961789/ /pubmed/21202983 http://dx.doi.org/10.1107/S1600536808019120 Text en © Gowda et al. 2008 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
Gowda, B. Thimme
Tokarčík, Miroslav
Kožíšek, Jozef
Sowmya, B. P.
Fuess, Hartmut
4-Chloro-N-(2,6-dimethyl­phen­yl)benzamide
title 4-Chloro-N-(2,6-dimethyl­phen­yl)benzamide
title_full 4-Chloro-N-(2,6-dimethyl­phen­yl)benzamide
title_fullStr 4-Chloro-N-(2,6-dimethyl­phen­yl)benzamide
title_full_unstemmed 4-Chloro-N-(2,6-dimethyl­phen­yl)benzamide
title_short 4-Chloro-N-(2,6-dimethyl­phen­yl)benzamide
title_sort 4-chloro-n-(2,6-dimethyl­phen­yl)benzamide
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961789/
https://www.ncbi.nlm.nih.gov/pubmed/21202983
http://dx.doi.org/10.1107/S1600536808019120
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AT fuesshartmut 4chloron26dimethylphenylbenzamide