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Crystal structure of (E)-1-methyl-2-[2-(2-methoxphenyl)ethenyl]-4-nitro-1H-imidazole
In the asymmetric unit of the title compound, C(13)H(13)N(3)O(3), the 2-(2-methoxphenyl)ethenyl unit is connected to the methyl-nitroimidazole 1-methyl-4-nitro-1H-imidazole moiety. The molecule is quasi-planar and the planes of the two rings form a dihedral angle of 0.92 (11)°. The crystal packin...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2014
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4186069/ https://www.ncbi.nlm.nih.gov/pubmed/25309283 http://dx.doi.org/10.1107/S1600536814017206 |
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author | Alliouche, Hayette Bouraiou, Abdelmalek Bouacida, Sofiane Merazig, Hocine Belfaitah, Ali |
author_facet | Alliouche, Hayette Bouraiou, Abdelmalek Bouacida, Sofiane Merazig, Hocine Belfaitah, Ali |
author_sort | Alliouche, Hayette |
collection | PubMed |
description | In the asymmetric unit of the title compound, C(13)H(13)N(3)O(3), the 2-(2-methoxphenyl)ethenyl unit is connected to the methyl-nitroimidazole 1-methyl-4-nitro-1H-imidazole moiety. The molecule is quasi-planar and the planes of the two rings form a dihedral angle of 0.92 (11)°. The crystal packing can be described as layers parallel to the (011) plane, stabilized by intermolecular C—H⋯O hydrogen bonding, resulting in the formation of an infinite three-dimensional network linking these layers. Strong π–π stacking interactions are observed, viz. benzene–benzene, imidazole–imidazole and benzene–imidazole rings, with centroid–centroid distances of 3.528 (2), 3.457 (2) and 3.544 (2) Å, respectively. Intensity statistics indicated twinning by non-merohedry, with refined weighs of the twin components of 0.3687:0.6313. |
format | Online Article Text |
id | pubmed-4186069 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2014 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-41860692014-10-12 Crystal structure of (E)-1-methyl-2-[2-(2-methoxphenyl)ethenyl]-4-nitro-1H-imidazole Alliouche, Hayette Bouraiou, Abdelmalek Bouacida, Sofiane Merazig, Hocine Belfaitah, Ali Acta Crystallogr Sect E Struct Rep Online Data Reports In the asymmetric unit of the title compound, C(13)H(13)N(3)O(3), the 2-(2-methoxphenyl)ethenyl unit is connected to the methyl-nitroimidazole 1-methyl-4-nitro-1H-imidazole moiety. The molecule is quasi-planar and the planes of the two rings form a dihedral angle of 0.92 (11)°. The crystal packing can be described as layers parallel to the (011) plane, stabilized by intermolecular C—H⋯O hydrogen bonding, resulting in the formation of an infinite three-dimensional network linking these layers. Strong π–π stacking interactions are observed, viz. benzene–benzene, imidazole–imidazole and benzene–imidazole rings, with centroid–centroid distances of 3.528 (2), 3.457 (2) and 3.544 (2) Å, respectively. Intensity statistics indicated twinning by non-merohedry, with refined weighs of the twin components of 0.3687:0.6313. International Union of Crystallography 2014-08-01 /pmc/articles/PMC4186069/ /pubmed/25309283 http://dx.doi.org/10.1107/S1600536814017206 Text en © Alliouche et al. 2014 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 | Data Reports Alliouche, Hayette Bouraiou, Abdelmalek Bouacida, Sofiane Merazig, Hocine Belfaitah, Ali Crystal structure of (E)-1-methyl-2-[2-(2-methoxphenyl)ethenyl]-4-nitro-1H-imidazole |
title | Crystal structure of (E)-1-methyl-2-[2-(2-methoxphenyl)ethenyl]-4-nitro-1H-imidazole |
title_full | Crystal structure of (E)-1-methyl-2-[2-(2-methoxphenyl)ethenyl]-4-nitro-1H-imidazole |
title_fullStr | Crystal structure of (E)-1-methyl-2-[2-(2-methoxphenyl)ethenyl]-4-nitro-1H-imidazole |
title_full_unstemmed | Crystal structure of (E)-1-methyl-2-[2-(2-methoxphenyl)ethenyl]-4-nitro-1H-imidazole |
title_short | Crystal structure of (E)-1-methyl-2-[2-(2-methoxphenyl)ethenyl]-4-nitro-1H-imidazole |
title_sort | crystal structure of (e)-1-methyl-2-[2-(2-methoxphenyl)ethenyl]-4-nitro-1h-imidazole |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4186069/ https://www.ncbi.nlm.nih.gov/pubmed/25309283 http://dx.doi.org/10.1107/S1600536814017206 |
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