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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...

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Autores principales: Said, Mohamed El Hadi, Bouacida, Sofiane, Merazig, Hocine, Belfaitah, Ali, Chibani, Aissa, Bouraiou, Abdelmalek
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
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).
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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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