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2-Hydroxymethyl-1,3-dimethyl-1H-benzimidazol-3-ium iodide
In the cation of the title compound, C(10)H(13)N(2)O(+)·I(−), all non-H atoms, with the exception of the O atom, are essentially coplanar, with a maximum deviation of 0.04 (1) Å. In the crystal, the cations and anions are arranged in layers parallel to (100). The cations are connected to the anions...
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/PMC3884380/ https://www.ncbi.nlm.nih.gov/pubmed/24427061 http://dx.doi.org/10.1107/S1600536813022307 |
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author | Said, Mohamed El Hadi Bouacida, Sofiane Merazig, Hocine Belfaitah, Ali Chibani, Aissa Bouraiou, Abdelmalek |
author_facet | Said, Mohamed El Hadi Bouacida, Sofiane Merazig, Hocine Belfaitah, Ali Chibani, Aissa Bouraiou, Abdelmalek |
author_sort | Said, Mohamed El Hadi |
collection | PubMed |
description | In the cation of the title compound, C(10)H(13)N(2)O(+)·I(−), all non-H atoms, with the exception of the O atom, are essentially coplanar, with a maximum deviation of 0.04 (1) Å. In the crystal, the cations and anions are arranged in layers parallel to (100). The cations are connected to the anions via an O—H⋯I hydrogen bond and there are significant π–π stacking interactions between cation layers, with centroid–centroid distances in the range 3.606 (5)–3.630 (5) Å. A weak intramolecular C—H⋯O hydrogen bond is also observed. The crystal studied was an inversion twin with refined components of 0.52 (5) and 0.48 (5). |
format | Online Article Text |
id | pubmed-3884380 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2013 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-38843802014-01-14 2-Hydroxymethyl-1,3-dimethyl-1H-benzimidazol-3-ium iodide Said, Mohamed El Hadi Bouacida, Sofiane Merazig, Hocine Belfaitah, Ali Chibani, Aissa Bouraiou, Abdelmalek Acta Crystallogr Sect E Struct Rep Online Organic Papers In the cation of the title compound, C(10)H(13)N(2)O(+)·I(−), all non-H atoms, with the exception of the O atom, are essentially coplanar, with a maximum deviation of 0.04 (1) Å. In the crystal, the cations and anions are arranged in layers parallel to (100). The cations are connected to the anions via an O—H⋯I hydrogen bond and there are significant π–π stacking interactions between cation layers, with centroid–centroid distances in the range 3.606 (5)–3.630 (5) Å. A weak intramolecular C—H⋯O hydrogen bond is also observed. The crystal studied was an inversion twin with refined components of 0.52 (5) and 0.48 (5). International Union of Crystallography 2013-08-14 /pmc/articles/PMC3884380/ /pubmed/24427061 http://dx.doi.org/10.1107/S1600536813022307 Text en © Said 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 Said, Mohamed El Hadi Bouacida, Sofiane Merazig, Hocine Belfaitah, Ali Chibani, Aissa Bouraiou, Abdelmalek 2-Hydroxymethyl-1,3-dimethyl-1H-benzimidazol-3-ium iodide |
title | 2-Hydroxymethyl-1,3-dimethyl-1H-benzimidazol-3-ium iodide |
title_full | 2-Hydroxymethyl-1,3-dimethyl-1H-benzimidazol-3-ium iodide |
title_fullStr | 2-Hydroxymethyl-1,3-dimethyl-1H-benzimidazol-3-ium iodide |
title_full_unstemmed | 2-Hydroxymethyl-1,3-dimethyl-1H-benzimidazol-3-ium iodide |
title_short | 2-Hydroxymethyl-1,3-dimethyl-1H-benzimidazol-3-ium iodide |
title_sort | 2-hydroxymethyl-1,3-dimethyl-1h-benzimidazol-3-ium iodide |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3884380/ https://www.ncbi.nlm.nih.gov/pubmed/24427061 http://dx.doi.org/10.1107/S1600536813022307 |
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