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1-Allyl-5-nitro-1H-benzimidazol-2(3H)-one
The benzimidazolone residue in the title molecule, C(10)H(9)N(3)O(3), is almost planar, with the largest deviation from the mean plane being 0.016 (2) Å for the C atom linked to the nitro group. This plane is nearly perpendicular to the 1-allyl chain as indicated by the C—N—C—C torsion angle of 90....
Autores principales: | , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2013
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3588436/ https://www.ncbi.nlm.nih.gov/pubmed/23476602 http://dx.doi.org/10.1107/S1600536813004790 |
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author | Ouzidan, Younès Kandri Rodi, Youssef Kandri Rodi, Adiba Essassi, El Mokhtar Saadi, Mohamed El Ammari, Lahcen |
author_facet | Ouzidan, Younès Kandri Rodi, Youssef Kandri Rodi, Adiba Essassi, El Mokhtar Saadi, Mohamed El Ammari, Lahcen |
author_sort | Ouzidan, Younès |
collection | PubMed |
description | The benzimidazolone residue in the title molecule, C(10)H(9)N(3)O(3), is almost planar, with the largest deviation from the mean plane being 0.016 (2) Å for the C atom linked to the nitro group. This plane is nearly perpendicular to the 1-allyl chain as indicated by the C—N—C—C torsion angle of 90.9 (3)°. The fused-ring system makes a dihedral angle of 5.6 (3)° with the nitro group, leading to a synperiplanar conformation. In the crystal, zigzag supramolecular chains are formed along the a axis by N—H⋯O hydrogen bonds. |
format | Online Article Text |
id | pubmed-3588436 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2013 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-35884362013-03-08 1-Allyl-5-nitro-1H-benzimidazol-2(3H)-one Ouzidan, Younès Kandri Rodi, Youssef Kandri Rodi, Adiba Essassi, El Mokhtar Saadi, Mohamed El Ammari, Lahcen Acta Crystallogr Sect E Struct Rep Online Organic Papers The benzimidazolone residue in the title molecule, C(10)H(9)N(3)O(3), is almost planar, with the largest deviation from the mean plane being 0.016 (2) Å for the C atom linked to the nitro group. This plane is nearly perpendicular to the 1-allyl chain as indicated by the C—N—C—C torsion angle of 90.9 (3)°. The fused-ring system makes a dihedral angle of 5.6 (3)° with the nitro group, leading to a synperiplanar conformation. In the crystal, zigzag supramolecular chains are formed along the a axis by N—H⋯O hydrogen bonds. International Union of Crystallography 2013-02-23 /pmc/articles/PMC3588436/ /pubmed/23476602 http://dx.doi.org/10.1107/S1600536813004790 Text en © Ouzidan et al. 2013 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 Ouzidan, Younès Kandri Rodi, Youssef Kandri Rodi, Adiba Essassi, El Mokhtar Saadi, Mohamed El Ammari, Lahcen 1-Allyl-5-nitro-1H-benzimidazol-2(3H)-one |
title | 1-Allyl-5-nitro-1H-benzimidazol-2(3H)-one |
title_full | 1-Allyl-5-nitro-1H-benzimidazol-2(3H)-one |
title_fullStr | 1-Allyl-5-nitro-1H-benzimidazol-2(3H)-one |
title_full_unstemmed | 1-Allyl-5-nitro-1H-benzimidazol-2(3H)-one |
title_short | 1-Allyl-5-nitro-1H-benzimidazol-2(3H)-one |
title_sort | 1-allyl-5-nitro-1h-benzimidazol-2(3h)-one |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3588436/ https://www.ncbi.nlm.nih.gov/pubmed/23476602 http://dx.doi.org/10.1107/S1600536813004790 |
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