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1-[2-(1H-Benzimidazol-2-yl)ethyl]-1H-1,2,3-benzotriazole
In the title compound, C(15)H(13)N(5), the N-containing heterocycles are linked by an ethylene spacer in a gauche conformation, the N—C—C—C torsion angle along the linker being 60.1 (3)°. The dihedral angle between the terminal benzotriazole and benzimidazole rings is 39.02 (6)°. In the crystal, ad...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2011
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3238838/ https://www.ncbi.nlm.nih.gov/pubmed/22199691 http://dx.doi.org/10.1107/S1600536811045442 |
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author | Zhang, Zhong Lu, Wei Wu, Difeng |
author_facet | Zhang, Zhong Lu, Wei Wu, Difeng |
author_sort | Zhang, Zhong |
collection | PubMed |
description | In the title compound, C(15)H(13)N(5), the N-containing heterocycles are linked by an ethylene spacer in a gauche conformation, the N—C—C—C torsion angle along the linker being 60.1 (3)°. The dihedral angle between the terminal benzotriazole and benzimidazole rings is 39.02 (6)°. In the crystal, adjacent molecules are connected by N—H⋯N hydrogen bonds, forming an infinite chain along the c axis. π–π stacking interactions [centroid–centroid distance = 3.8772 (7) Å] between the benzotriazole rings of neighbouring chains extend these chains into a supramolecular sheet in the bc plane. Weak intermolecular C—H⋯N interactions further stabilize the crystal structure. |
format | Online Article Text |
id | pubmed-3238838 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2011 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-32388382011-12-23 1-[2-(1H-Benzimidazol-2-yl)ethyl]-1H-1,2,3-benzotriazole Zhang, Zhong Lu, Wei Wu, Difeng Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(15)H(13)N(5), the N-containing heterocycles are linked by an ethylene spacer in a gauche conformation, the N—C—C—C torsion angle along the linker being 60.1 (3)°. The dihedral angle between the terminal benzotriazole and benzimidazole rings is 39.02 (6)°. In the crystal, adjacent molecules are connected by N—H⋯N hydrogen bonds, forming an infinite chain along the c axis. π–π stacking interactions [centroid–centroid distance = 3.8772 (7) Å] between the benzotriazole rings of neighbouring chains extend these chains into a supramolecular sheet in the bc plane. Weak intermolecular C—H⋯N interactions further stabilize the crystal structure. International Union of Crystallography 2011-11-05 /pmc/articles/PMC3238838/ /pubmed/22199691 http://dx.doi.org/10.1107/S1600536811045442 Text en © Zhang 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 Zhang, Zhong Lu, Wei Wu, Difeng 1-[2-(1H-Benzimidazol-2-yl)ethyl]-1H-1,2,3-benzotriazole |
title | 1-[2-(1H-Benzimidazol-2-yl)ethyl]-1H-1,2,3-benzotriazole |
title_full | 1-[2-(1H-Benzimidazol-2-yl)ethyl]-1H-1,2,3-benzotriazole |
title_fullStr | 1-[2-(1H-Benzimidazol-2-yl)ethyl]-1H-1,2,3-benzotriazole |
title_full_unstemmed | 1-[2-(1H-Benzimidazol-2-yl)ethyl]-1H-1,2,3-benzotriazole |
title_short | 1-[2-(1H-Benzimidazol-2-yl)ethyl]-1H-1,2,3-benzotriazole |
title_sort | 1-[2-(1h-benzimidazol-2-yl)ethyl]-1h-1,2,3-benzotriazole |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3238838/ https://www.ncbi.nlm.nih.gov/pubmed/22199691 http://dx.doi.org/10.1107/S1600536811045442 |
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