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2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl methanesulfonate
The asymmetric unit of the title compound, C(7)H(11)N(3)O(5)S, contains two independent molecules with virtually identical conformations. The imidazole rings of both molecules are essentially planar (r.m.s. deviations = 0.0019 and 0.0038 Å), with a dihedral angle 9.25 (19)° between them. The nitro...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2012
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3435813/ https://www.ncbi.nlm.nih.gov/pubmed/22969659 http://dx.doi.org/10.1107/S1600536812034964 |
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author | Yousuf, Sammer Zeb, Aurang Batool, Farhana Basha, Fatima Z. |
author_facet | Yousuf, Sammer Zeb, Aurang Batool, Farhana Basha, Fatima Z. |
author_sort | Yousuf, Sammer |
collection | PubMed |
description | The asymmetric unit of the title compound, C(7)H(11)N(3)O(5)S, contains two independent molecules with virtually identical conformations. The imidazole rings of both molecules are essentially planar (r.m.s. deviations = 0.0019 and 0.0038 Å), with a dihedral angle 9.25 (19)° between them. The nitro groups are oriented at 4.5 (2) and 6.44 (13)° with respect to the imidazole rings. In the crystal, molecules are linked to form a three-dimensional framework by C—H⋯O and C—H⋯N hydrogen bonds. |
format | Online Article Text |
id | pubmed-3435813 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-34358132012-09-11 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl methanesulfonate Yousuf, Sammer Zeb, Aurang Batool, Farhana Basha, Fatima Z. Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, C(7)H(11)N(3)O(5)S, contains two independent molecules with virtually identical conformations. The imidazole rings of both molecules are essentially planar (r.m.s. deviations = 0.0019 and 0.0038 Å), with a dihedral angle 9.25 (19)° between them. The nitro groups are oriented at 4.5 (2) and 6.44 (13)° with respect to the imidazole rings. In the crystal, molecules are linked to form a three-dimensional framework by C—H⋯O and C—H⋯N hydrogen bonds. International Union of Crystallography 2012-08-25 /pmc/articles/PMC3435813/ /pubmed/22969659 http://dx.doi.org/10.1107/S1600536812034964 Text en © Yousuf et al. 2012 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 Yousuf, Sammer Zeb, Aurang Batool, Farhana Basha, Fatima Z. 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl methanesulfonate |
title | 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl methanesulfonate |
title_full | 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl methanesulfonate |
title_fullStr | 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl methanesulfonate |
title_full_unstemmed | 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl methanesulfonate |
title_short | 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl methanesulfonate |
title_sort | 2-(2-methyl-5-nitro-1h-imidazol-1-yl)ethyl methanesulfonate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3435813/ https://www.ncbi.nlm.nih.gov/pubmed/22969659 http://dx.doi.org/10.1107/S1600536812034964 |
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