Methyl 2-(4-chloro-3,5-dinitro­benz­amido)­acetate

The title mol­ecule, C(10)H(8)ClN(3)O(7), is twisted with the dihedral angle between the amide and benzene ring being 38.75 (11)°. The C—N—C—C torsion angle between the amide and acetyl groups is −150.1 (2)°. Finally, each nitro group is twisted out of the plane of the benzene ring to which it is co...

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Detalles Bibliográficos
Autores principales: Wu, Xiang-Xiang, Wu, Xue-Fen, Hou, Yi-Min, Ng, Seik Weng, Tiekink, Edward R. T.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3239110/
https://www.ncbi.nlm.nih.gov/pubmed/22199958
http://dx.doi.org/10.1107/S1600536811050446
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author Wu, Xiang-Xiang
Wu, Xue-Fen
Hou, Yi-Min
Ng, Seik Weng
Tiekink, Edward R. T.
author_facet Wu, Xiang-Xiang
Wu, Xue-Fen
Hou, Yi-Min
Ng, Seik Weng
Tiekink, Edward R. T.
author_sort Wu, Xiang-Xiang
collection PubMed
description The title mol­ecule, C(10)H(8)ClN(3)O(7), is twisted with the dihedral angle between the amide and benzene ring being 38.75 (11)°. The C—N—C—C torsion angle between the amide and acetyl groups is −150.1 (2)°. Finally, each nitro group is twisted out of the plane of the benzene ring to which it is connected [O—N—C—C torsion angles = 34.0 (3) and −64.5 (3)°]. Linear supra­molecular chains along [010] and mediated by N—H⋯O hydrogen bonds between successive amide groups dominate the crystal packing. The chains are consolidated into the three-dimensional structure by C—H⋯O contacts.
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spelling pubmed-32391102011-12-23 Methyl 2-(4-chloro-3,5-dinitro­benz­amido)­acetate Wu, Xiang-Xiang Wu, Xue-Fen Hou, Yi-Min Ng, Seik Weng Tiekink, Edward R. T. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title mol­ecule, C(10)H(8)ClN(3)O(7), is twisted with the dihedral angle between the amide and benzene ring being 38.75 (11)°. The C—N—C—C torsion angle between the amide and acetyl groups is −150.1 (2)°. Finally, each nitro group is twisted out of the plane of the benzene ring to which it is connected [O—N—C—C torsion angles = 34.0 (3) and −64.5 (3)°]. Linear supra­molecular chains along [010] and mediated by N—H⋯O hydrogen bonds between successive amide groups dominate the crystal packing. The chains are consolidated into the three-dimensional structure by C—H⋯O contacts. International Union of Crystallography 2011-11-30 /pmc/articles/PMC3239110/ /pubmed/22199958 http://dx.doi.org/10.1107/S1600536811050446 Text en © Wu et al. 2011 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
Wu, Xiang-Xiang
Wu, Xue-Fen
Hou, Yi-Min
Ng, Seik Weng
Tiekink, Edward R. T.
Methyl 2-(4-chloro-3,5-dinitro­benz­amido)­acetate
title Methyl 2-(4-chloro-3,5-dinitro­benz­amido)­acetate
title_full Methyl 2-(4-chloro-3,5-dinitro­benz­amido)­acetate
title_fullStr Methyl 2-(4-chloro-3,5-dinitro­benz­amido)­acetate
title_full_unstemmed Methyl 2-(4-chloro-3,5-dinitro­benz­amido)­acetate
title_short Methyl 2-(4-chloro-3,5-dinitro­benz­amido)­acetate
title_sort methyl 2-(4-chloro-3,5-dinitro­benz­amido)­acetate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3239110/
https://www.ncbi.nlm.nih.gov/pubmed/22199958
http://dx.doi.org/10.1107/S1600536811050446
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AT wuxuefen methyl24chloro35dinitrobenzamidoacetate
AT houyimin methyl24chloro35dinitrobenzamidoacetate
AT ngseikweng methyl24chloro35dinitrobenzamidoacetate
AT tiekinkedwardrt methyl24chloro35dinitrobenzamidoacetate

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