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3,3′-[1,4-Phenyl­enebis(methyl­ene)]­bis­(1-propyl­benzimidazolium) dichloride dihydrate

The asymmetric unit of the title compound, C(28)H(32)N(4) (2+)·2Cl(−)·2H(2)O, contains half of a 3,3′-[1,4-phenyl­enebis(methyl­ene)]bis­(1-propyl­benzimidazolium) cation, one chloride anion and one water mol­ecule. The complete cation is generated by a crystallographic inversion center. The central...

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Autores principales: Haque, Rosenani A., Iqbal, Muhammad Adnan, Ahmad, Safaa A., Chia, Tze Shyang, Fun, Hoong-Kun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3297903/
https://www.ncbi.nlm.nih.gov/pubmed/22412706
http://dx.doi.org/10.1107/S1600536812007738
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author Haque, Rosenani A.
Iqbal, Muhammad Adnan
Ahmad, Safaa A.
Chia, Tze Shyang
Fun, Hoong-Kun
author_facet Haque, Rosenani A.
Iqbal, Muhammad Adnan
Ahmad, Safaa A.
Chia, Tze Shyang
Fun, Hoong-Kun
author_sort Haque, Rosenani A.
collection PubMed
description The asymmetric unit of the title compound, C(28)H(32)N(4) (2+)·2Cl(−)·2H(2)O, contains half of a 3,3′-[1,4-phenyl­enebis(methyl­ene)]bis­(1-propyl­benzimidazolium) cation, one chloride anion and one water mol­ecule. The complete cation is generated by a crystallographic inversion center. The central benzene ring forms a dihedral angle of 66.06 (11)° with its adjacent benzimidazolium ring system. In the crystal, the cations, anions and water mol­ecules are linked by O—H⋯Cl, C—H⋯O and C—H⋯Cl hydrogen bonds into a three-dimensional network. The crystal packing is further stabilized by π–π inter­actions, with centroid–centroid distances of 3.5561 (15) and 3.6708 (15) Å.
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spelling pubmed-32979032012-03-12 3,3′-[1,4-Phenyl­enebis(methyl­ene)]­bis­(1-propyl­benzimidazolium) dichloride dihydrate Haque, Rosenani A. Iqbal, Muhammad Adnan Ahmad, Safaa A. Chia, Tze Shyang Fun, Hoong-Kun Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, C(28)H(32)N(4) (2+)·2Cl(−)·2H(2)O, contains half of a 3,3′-[1,4-phenyl­enebis(methyl­ene)]bis­(1-propyl­benzimidazolium) cation, one chloride anion and one water mol­ecule. The complete cation is generated by a crystallographic inversion center. The central benzene ring forms a dihedral angle of 66.06 (11)° with its adjacent benzimidazolium ring system. In the crystal, the cations, anions and water mol­ecules are linked by O—H⋯Cl, C—H⋯O and C—H⋯Cl hydrogen bonds into a three-dimensional network. The crystal packing is further stabilized by π–π inter­actions, with centroid–centroid distances of 3.5561 (15) and 3.6708 (15) Å. International Union of Crystallography 2012-02-24 /pmc/articles/PMC3297903/ /pubmed/22412706 http://dx.doi.org/10.1107/S1600536812007738 Text en © Haque 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
Haque, Rosenani A.
Iqbal, Muhammad Adnan
Ahmad, Safaa A.
Chia, Tze Shyang
Fun, Hoong-Kun
3,3′-[1,4-Phenyl­enebis(methyl­ene)]­bis­(1-propyl­benzimidazolium) dichloride dihydrate
title 3,3′-[1,4-Phenyl­enebis(methyl­ene)]­bis­(1-propyl­benzimidazolium) dichloride dihydrate
title_full 3,3′-[1,4-Phenyl­enebis(methyl­ene)]­bis­(1-propyl­benzimidazolium) dichloride dihydrate
title_fullStr 3,3′-[1,4-Phenyl­enebis(methyl­ene)]­bis­(1-propyl­benzimidazolium) dichloride dihydrate
title_full_unstemmed 3,3′-[1,4-Phenyl­enebis(methyl­ene)]­bis­(1-propyl­benzimidazolium) dichloride dihydrate
title_short 3,3′-[1,4-Phenyl­enebis(methyl­ene)]­bis­(1-propyl­benzimidazolium) dichloride dihydrate
title_sort 3,3′-[1,4-phenyl­enebis(methyl­ene)]­bis­(1-propyl­benzimidazolium) dichloride dihydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3297903/
https://www.ncbi.nlm.nih.gov/pubmed/22412706
http://dx.doi.org/10.1107/S1600536812007738
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