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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...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2012
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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. |
format | Online Article Text |
id | pubmed-3297903 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
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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