3,3′-[1,2-Phenyl­enebis(methyl­ene)]bis­(1-heptyl­benzimidazolium) dibromide monohydrate

In the title salt, C(36)H(48)N(4) (2+)·2Br(−)·H(2)O, the central benzene ring makes dihedral angles of 84.77 (9) and 69.92 (7)° with the adjacent imidazole rings. In the crystal, one of the heptyl groups is disordered over two sets of sites with an occupancy ratio of 0.474 (5):0.526 (5). In the crys...

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Autores principales: Haque, Rosenani A., Iqbal, Muhammad Adnan, Hemamalini, Madhukar, Fun, Hoong-Kun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3152130/
https://www.ncbi.nlm.nih.gov/pubmed/21837184
http://dx.doi.org/10.1107/S1600536811023476
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author Haque, Rosenani A.
Iqbal, Muhammad Adnan
Hemamalini, Madhukar
Fun, Hoong-Kun
author_facet Haque, Rosenani A.
Iqbal, Muhammad Adnan
Hemamalini, Madhukar
Fun, Hoong-Kun
author_sort Haque, Rosenani A.
collection PubMed
description In the title salt, C(36)H(48)N(4) (2+)·2Br(−)·H(2)O, the central benzene ring makes dihedral angles of 84.77 (9) and 69.92 (7)° with the adjacent imidazole rings. In the crystal, one of the heptyl groups is disordered over two sets of sites with an occupancy ratio of 0.474 (5):0.526 (5). In the crystal, the cations, anions and water mol­ecules are connected via inter­molecular O—H⋯Br, C—H⋯Br and C—H⋯O hydrogen bonds, forming a three-dimensional network.
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spelling pubmed-31521302011-08-11 3,3′-[1,2-Phenyl­enebis(methyl­ene)]bis­(1-heptyl­benzimidazolium) dibromide monohydrate Haque, Rosenani A. Iqbal, Muhammad Adnan Hemamalini, Madhukar Fun, Hoong-Kun Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title salt, C(36)H(48)N(4) (2+)·2Br(−)·H(2)O, the central benzene ring makes dihedral angles of 84.77 (9) and 69.92 (7)° with the adjacent imidazole rings. In the crystal, one of the heptyl groups is disordered over two sets of sites with an occupancy ratio of 0.474 (5):0.526 (5). In the crystal, the cations, anions and water mol­ecules are connected via inter­molecular O—H⋯Br, C—H⋯Br and C—H⋯O hydrogen bonds, forming a three-dimensional network. International Union of Crystallography 2011-06-25 /pmc/articles/PMC3152130/ /pubmed/21837184 http://dx.doi.org/10.1107/S1600536811023476 Text en © Haque et al. 2011 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
Haque, Rosenani A.
Iqbal, Muhammad Adnan
Hemamalini, Madhukar
Fun, Hoong-Kun
3,3′-[1,2-Phenyl­enebis(methyl­ene)]bis­(1-heptyl­benzimidazolium) dibromide monohydrate
title 3,3′-[1,2-Phenyl­enebis(methyl­ene)]bis­(1-heptyl­benzimidazolium) dibromide monohydrate
title_full 3,3′-[1,2-Phenyl­enebis(methyl­ene)]bis­(1-heptyl­benzimidazolium) dibromide monohydrate
title_fullStr 3,3′-[1,2-Phenyl­enebis(methyl­ene)]bis­(1-heptyl­benzimidazolium) dibromide monohydrate
title_full_unstemmed 3,3′-[1,2-Phenyl­enebis(methyl­ene)]bis­(1-heptyl­benzimidazolium) dibromide monohydrate
title_short 3,3′-[1,2-Phenyl­enebis(methyl­ene)]bis­(1-heptyl­benzimidazolium) dibromide monohydrate
title_sort 3,3′-[1,2-phenyl­enebis(methyl­ene)]bis­(1-heptyl­benzimidazolium) dibromide monohydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3152130/
https://www.ncbi.nlm.nih.gov/pubmed/21837184
http://dx.doi.org/10.1107/S1600536811023476
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