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3,3′-[1,2-Phenylenebis(methylene)]bis(1-ethyl-1H-benzimidazol-1-ium) bis(hexaflourophosphate)
In the title compound, C(26)H(28)N(4) (2+)·2PF(6) (−), the complete cation is generated by a crystallographic twofold axis. The benzimidazole ring is almost planar (r.m.s. deviation = 0.0207 Å) and makes dihedral angles of 50.12 (2)° with its symmetry-related component and 65.81 (2)° with the centr...
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/PMC3379238/ https://www.ncbi.nlm.nih.gov/pubmed/22719436 http://dx.doi.org/10.1107/S1600536812019344 |
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author | Haque, Rosenani A. Iqbal, Muhammad Adnan Rosli, Mohd Mustaqim Fun, Hoong-Kun |
author_facet | Haque, Rosenani A. Iqbal, Muhammad Adnan Rosli, Mohd Mustaqim Fun, Hoong-Kun |
author_sort | Haque, Rosenani A. |
collection | PubMed |
description | In the title compound, C(26)H(28)N(4) (2+)·2PF(6) (−), the complete cation is generated by a crystallographic twofold axis. The benzimidazole ring is almost planar (r.m.s. deviation = 0.0207 Å) and makes dihedral angles of 50.12 (2)° with its symmetry-related component and 65.81 (2)° with the central benzene ring. In the crystal, molecules are linked into a three-dimensional network by C—H⋯F interactions. A π–π interaction with a centroid–centroid distance of 3.530 (1) Å is observed. Four F atoms of the hexafluorophosphate anion are disordered over two sets of sites in a 0.889 (6):0.111 (6) ratio. |
format | Online Article Text |
id | pubmed-3379238 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-33792382012-06-20 3,3′-[1,2-Phenylenebis(methylene)]bis(1-ethyl-1H-benzimidazol-1-ium) bis(hexaflourophosphate) Haque, Rosenani A. Iqbal, Muhammad Adnan Rosli, Mohd Mustaqim Fun, Hoong-Kun Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(26)H(28)N(4) (2+)·2PF(6) (−), the complete cation is generated by a crystallographic twofold axis. The benzimidazole ring is almost planar (r.m.s. deviation = 0.0207 Å) and makes dihedral angles of 50.12 (2)° with its symmetry-related component and 65.81 (2)° with the central benzene ring. In the crystal, molecules are linked into a three-dimensional network by C—H⋯F interactions. A π–π interaction with a centroid–centroid distance of 3.530 (1) Å is observed. Four F atoms of the hexafluorophosphate anion are disordered over two sets of sites in a 0.889 (6):0.111 (6) ratio. International Union of Crystallography 2012-05-05 /pmc/articles/PMC3379238/ /pubmed/22719436 http://dx.doi.org/10.1107/S1600536812019344 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 Rosli, Mohd Mustaqim Fun, Hoong-Kun 3,3′-[1,2-Phenylenebis(methylene)]bis(1-ethyl-1H-benzimidazol-1-ium) bis(hexaflourophosphate) |
title | 3,3′-[1,2-Phenylenebis(methylene)]bis(1-ethyl-1H-benzimidazol-1-ium) bis(hexaflourophosphate) |
title_full | 3,3′-[1,2-Phenylenebis(methylene)]bis(1-ethyl-1H-benzimidazol-1-ium) bis(hexaflourophosphate) |
title_fullStr | 3,3′-[1,2-Phenylenebis(methylene)]bis(1-ethyl-1H-benzimidazol-1-ium) bis(hexaflourophosphate) |
title_full_unstemmed | 3,3′-[1,2-Phenylenebis(methylene)]bis(1-ethyl-1H-benzimidazol-1-ium) bis(hexaflourophosphate) |
title_short | 3,3′-[1,2-Phenylenebis(methylene)]bis(1-ethyl-1H-benzimidazol-1-ium) bis(hexaflourophosphate) |
title_sort | 3,3′-[1,2-phenylenebis(methylene)]bis(1-ethyl-1h-benzimidazol-1-ium) bis(hexaflourophosphate) |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3379238/ https://www.ncbi.nlm.nih.gov/pubmed/22719436 http://dx.doi.org/10.1107/S1600536812019344 |
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