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1,3,5-Tris(N-phenylbenzimidazol-2-yl)benzene methanol solvate
The main molecule of the title compound, C(45)H(30)N(6)·CH(3)OH, has a non-planar core: the dihedral angles between the benzimidazole rings and the central benzene ring are 20.19 (10), 34.57 (8), and 44.59 (8)°, while the dihedral angles between the peripheral phenyl rings and the attached benzimid...
Autores principales: | , , , , |
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Formato: | Texto |
Lenguaje: | English |
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International Union of Crystallography
2009
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2970194/ https://www.ncbi.nlm.nih.gov/pubmed/21577916 http://dx.doi.org/10.1107/S1600536809036046 |
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author | Song, Wei-Feng Wu, Ying Fan, Yan Wang, Yue Liu, Yu |
author_facet | Song, Wei-Feng Wu, Ying Fan, Yan Wang, Yue Liu, Yu |
author_sort | Song, Wei-Feng |
collection | PubMed |
description | The main molecule of the title compound, C(45)H(30)N(6)·CH(3)OH, has a non-planar core: the dihedral angles between the benzimidazole rings and the central benzene ring are 20.19 (10), 34.57 (8), and 44.59 (8)°, while the dihedral angles between the peripheral phenyl rings and the attached benzimidazole rings are 84.57 (7), 62.71 (6) and 51.73 (6)°. The tri-substituted benzene molecule is connected to the methanol solvent molecule through an O—H⋯N hydrogen bond, forming a 1:1 solvate. In the crystal structure, no significant π–π interactions are present, and the molecules are associated through weak C—H⋯N and C—H⋯O(methanol) contacts. |
format | Text |
id | pubmed-2970194 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2009 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29701942010-12-30 1,3,5-Tris(N-phenylbenzimidazol-2-yl)benzene methanol solvate Song, Wei-Feng Wu, Ying Fan, Yan Wang, Yue Liu, Yu Acta Crystallogr Sect E Struct Rep Online Organic Papers The main molecule of the title compound, C(45)H(30)N(6)·CH(3)OH, has a non-planar core: the dihedral angles between the benzimidazole rings and the central benzene ring are 20.19 (10), 34.57 (8), and 44.59 (8)°, while the dihedral angles between the peripheral phenyl rings and the attached benzimidazole rings are 84.57 (7), 62.71 (6) and 51.73 (6)°. The tri-substituted benzene molecule is connected to the methanol solvent molecule through an O—H⋯N hydrogen bond, forming a 1:1 solvate. In the crystal structure, no significant π–π interactions are present, and the molecules are associated through weak C—H⋯N and C—H⋯O(methanol) contacts. International Union of Crystallography 2009-09-12 /pmc/articles/PMC2970194/ /pubmed/21577916 http://dx.doi.org/10.1107/S1600536809036046 Text en © Song et al. 2009 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 Song, Wei-Feng Wu, Ying Fan, Yan Wang, Yue Liu, Yu 1,3,5-Tris(N-phenylbenzimidazol-2-yl)benzene methanol solvate |
title | 1,3,5-Tris(N-phenylbenzimidazol-2-yl)benzene methanol solvate |
title_full | 1,3,5-Tris(N-phenylbenzimidazol-2-yl)benzene methanol solvate |
title_fullStr | 1,3,5-Tris(N-phenylbenzimidazol-2-yl)benzene methanol solvate |
title_full_unstemmed | 1,3,5-Tris(N-phenylbenzimidazol-2-yl)benzene methanol solvate |
title_short | 1,3,5-Tris(N-phenylbenzimidazol-2-yl)benzene methanol solvate |
title_sort | 1,3,5-tris(n-phenylbenzimidazol-2-yl)benzene methanol solvate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2970194/ https://www.ncbi.nlm.nih.gov/pubmed/21577916 http://dx.doi.org/10.1107/S1600536809036046 |
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