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N-(3-Methylphenyl)benzamide
The asymmetric unit of the title compound, C(14)H(13)NO, contains four molecules, which are linked through N—H⋯O hydrogen bonds into two symmetry-independent chains running parallel to [001] and [101]. The N—H and C=O bonds of the amide groups are trans oriented in all four molecules. The molecul...
Autores principales: | , , , |
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Formato: | Texto |
Lenguaje: | English |
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International Union of Crystallography
2008
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959694/ https://www.ncbi.nlm.nih.gov/pubmed/21581101 http://dx.doi.org/10.1107/S1600536808035186 |
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author | Gowda, B. Thimme Foro, Sabine Sowmya, B. P. Fuess, Hartmut |
author_facet | Gowda, B. Thimme Foro, Sabine Sowmya, B. P. Fuess, Hartmut |
author_sort | Gowda, B. Thimme |
collection | PubMed |
description | The asymmetric unit of the title compound, C(14)H(13)NO, contains four molecules, which are linked through N—H⋯O hydrogen bonds into two symmetry-independent chains running parallel to [001] and [101]. The N—H and C=O bonds of the amide groups are trans oriented in all four molecules. The molecules are not planar and both aromatic rings are twisted strongly relative to the plane of the amide group. The dihedral angle between the two benzene rings ranges from 70.6 (2) to 74.2 (2)°. The N—H bond is anti to the meta-methyl substituent in the aniline fragment in three of the four symmetry-independent molecules. In the fourth molecule, the aniline unit is disordered over two nearly coplanar positions; the anti and syn conformers occupy the same site in the crystal with equal probability. |
format | Text |
id | pubmed-2959694 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2008 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29596942010-12-30 N-(3-Methylphenyl)benzamide Gowda, B. Thimme Foro, Sabine Sowmya, B. P. Fuess, Hartmut Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, C(14)H(13)NO, contains four molecules, which are linked through N—H⋯O hydrogen bonds into two symmetry-independent chains running parallel to [001] and [101]. The N—H and C=O bonds of the amide groups are trans oriented in all four molecules. The molecules are not planar and both aromatic rings are twisted strongly relative to the plane of the amide group. The dihedral angle between the two benzene rings ranges from 70.6 (2) to 74.2 (2)°. The N—H bond is anti to the meta-methyl substituent in the aniline fragment in three of the four symmetry-independent molecules. In the fourth molecule, the aniline unit is disordered over two nearly coplanar positions; the anti and syn conformers occupy the same site in the crystal with equal probability. International Union of Crystallography 2008-10-31 /pmc/articles/PMC2959694/ /pubmed/21581101 http://dx.doi.org/10.1107/S1600536808035186 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 Foro, Sabine Sowmya, B. P. Fuess, Hartmut N-(3-Methylphenyl)benzamide |
title |
N-(3-Methylphenyl)benzamide |
title_full |
N-(3-Methylphenyl)benzamide |
title_fullStr |
N-(3-Methylphenyl)benzamide |
title_full_unstemmed |
N-(3-Methylphenyl)benzamide |
title_short |
N-(3-Methylphenyl)benzamide |
title_sort | n-(3-methylphenyl)benzamide |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959694/ https://www.ncbi.nlm.nih.gov/pubmed/21581101 http://dx.doi.org/10.1107/S1600536808035186 |
work_keys_str_mv | AT gowdabthimme n3methylphenylbenzamide AT forosabine n3methylphenylbenzamide AT sowmyabp n3methylphenylbenzamide AT fuesshartmut n3methylphenylbenzamide |