Cargando…

4-Nitro-N-(3-nitro­phen­yl)benzamide

The title compound, C(13)H(9)N(3)O(5), prepared as a solid derivative of 3-nitro­analine via reaction with 4-nitro­benzoyl chloride, crystallizes in a chiral space group. The mol­ecule is non-planar with a dihedral angle of 26.1 (1)° between the two benzene rings. Both nitro groups are twisted sligh...

Descripción completa

Detalles Bibliográficos
Autores principales: Johnston, Dean H., Taylor, Colin R.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3201324/
https://www.ncbi.nlm.nih.gov/pubmed/22065512
http://dx.doi.org/10.1107/S1600536811038062
_version_ 1782214848510164992
author Johnston, Dean H.
Taylor, Colin R.
author_facet Johnston, Dean H.
Taylor, Colin R.
author_sort Johnston, Dean H.
collection PubMed
description The title compound, C(13)H(9)N(3)O(5), prepared as a solid derivative of 3-nitro­analine via reaction with 4-nitro­benzoyl chloride, crystallizes in a chiral space group. The mol­ecule is non-planar with a dihedral angle of 26.1 (1)° between the two benzene rings. Both nitro groups are twisted slightly out of the plane of their corresponding benzene rings, making dihedral angles of 10.7 (4) and 13.5 (4)°. The mol­ecules are stacked along the a axis with benzene ring centroid–centroid distances of 3.8878 (6) Å. In the crystal, inter­molecular benzene C—H⋯O inter­actions involving one nitro group and the carbonyl group link the mol­ecules, forming chains along [001]. An additional set of aromatic C—H⋯O inter­actions with the second nitro group form chains along [101], connecting adjacent chains to create layers perpendicular to the b axis.
format Online
Article
Text
id pubmed-3201324
institution National Center for Biotechnology Information
language English
publishDate 2011
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-32013242011-11-06 4-Nitro-N-(3-nitro­phen­yl)benzamide Johnston, Dean H. Taylor, Colin R. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(13)H(9)N(3)O(5), prepared as a solid derivative of 3-nitro­analine via reaction with 4-nitro­benzoyl chloride, crystallizes in a chiral space group. The mol­ecule is non-planar with a dihedral angle of 26.1 (1)° between the two benzene rings. Both nitro groups are twisted slightly out of the plane of their corresponding benzene rings, making dihedral angles of 10.7 (4) and 13.5 (4)°. The mol­ecules are stacked along the a axis with benzene ring centroid–centroid distances of 3.8878 (6) Å. In the crystal, inter­molecular benzene C—H⋯O inter­actions involving one nitro group and the carbonyl group link the mol­ecules, forming chains along [001]. An additional set of aromatic C—H⋯O inter­actions with the second nitro group form chains along [101], connecting adjacent chains to create layers perpendicular to the b axis. International Union of Crystallography 2011-09-30 /pmc/articles/PMC3201324/ /pubmed/22065512 http://dx.doi.org/10.1107/S1600536811038062 Text en © Johnston and Taylor 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
Johnston, Dean H.
Taylor, Colin R.
4-Nitro-N-(3-nitro­phen­yl)benzamide
title 4-Nitro-N-(3-nitro­phen­yl)benzamide
title_full 4-Nitro-N-(3-nitro­phen­yl)benzamide
title_fullStr 4-Nitro-N-(3-nitro­phen­yl)benzamide
title_full_unstemmed 4-Nitro-N-(3-nitro­phen­yl)benzamide
title_short 4-Nitro-N-(3-nitro­phen­yl)benzamide
title_sort 4-nitro-n-(3-nitro­phen­yl)benzamide
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3201324/
https://www.ncbi.nlm.nih.gov/pubmed/22065512
http://dx.doi.org/10.1107/S1600536811038062
work_keys_str_mv AT johnstondeanh 4nitron3nitrophenylbenzamide
AT taylorcolinr 4nitron3nitrophenylbenzamide