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2-(5,6-Di­hydro­benzimidazolo[1,2-c]quinazolin-6-yl)aniline methanol solvate

In the structure of the title compound, C(20)H(16)N(4)·CH(4)O, the aniline ring forms dihedral angles of 89.9 (2) and 85.4 (2)° with the benzimidazole and benzene rings, respectively. The orientation of the aniline ring is mainly determined by strong hydrogen bonds between the amino group and the no...

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Detalles Bibliográficos
Autores principales: Booysen, Irvin, Gerber, Thomas I. A., Hosten, Eric, Mayer, Peter
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2969432/
https://www.ncbi.nlm.nih.gov/pubmed/21582846
http://dx.doi.org/10.1107/S1600536809021886
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author Booysen, Irvin
Gerber, Thomas I. A.
Hosten, Eric
Mayer, Peter
author_facet Booysen, Irvin
Gerber, Thomas I. A.
Hosten, Eric
Mayer, Peter
author_sort Booysen, Irvin
collection PubMed
description In the structure of the title compound, C(20)H(16)N(4)·CH(4)O, the aniline ring forms dihedral angles of 89.9 (2) and 85.4 (2)° with the benzimidazole and benzene rings, respectively. The orientation of the aniline ring is mainly determined by strong hydrogen bonds between the amino group and the non-fused quinazoline N atom. Inter­molecular hydrogen bonds of the N—H⋯N—H⋯N type along [010] and the N—H⋯O—H⋯N type along [100] are formed, resulting in C (2) (2)(4) and C (2) (2)(10) descriptors, respectively, on a binary level of graph-set analysis. There are C—H⋯π contacts with H⋯π distances of 2.44 Å; however, no π-stacking is observed.
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spelling pubmed-29694322010-12-30 2-(5,6-Di­hydro­benzimidazolo[1,2-c]quinazolin-6-yl)aniline methanol solvate Booysen, Irvin Gerber, Thomas I. A. Hosten, Eric Mayer, Peter Acta Crystallogr Sect E Struct Rep Online Organic Papers In the structure of the title compound, C(20)H(16)N(4)·CH(4)O, the aniline ring forms dihedral angles of 89.9 (2) and 85.4 (2)° with the benzimidazole and benzene rings, respectively. The orientation of the aniline ring is mainly determined by strong hydrogen bonds between the amino group and the non-fused quinazoline N atom. Inter­molecular hydrogen bonds of the N—H⋯N—H⋯N type along [010] and the N—H⋯O—H⋯N type along [100] are formed, resulting in C (2) (2)(4) and C (2) (2)(10) descriptors, respectively, on a binary level of graph-set analysis. There are C—H⋯π contacts with H⋯π distances of 2.44 Å; however, no π-stacking is observed. International Union of Crystallography 2009-06-13 /pmc/articles/PMC2969432/ /pubmed/21582846 http://dx.doi.org/10.1107/S1600536809021886 Text en © Booysen 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
Booysen, Irvin
Gerber, Thomas I. A.
Hosten, Eric
Mayer, Peter
2-(5,6-Di­hydro­benzimidazolo[1,2-c]quinazolin-6-yl)aniline methanol solvate
title 2-(5,6-Di­hydro­benzimidazolo[1,2-c]quinazolin-6-yl)aniline methanol solvate
title_full 2-(5,6-Di­hydro­benzimidazolo[1,2-c]quinazolin-6-yl)aniline methanol solvate
title_fullStr 2-(5,6-Di­hydro­benzimidazolo[1,2-c]quinazolin-6-yl)aniline methanol solvate
title_full_unstemmed 2-(5,6-Di­hydro­benzimidazolo[1,2-c]quinazolin-6-yl)aniline methanol solvate
title_short 2-(5,6-Di­hydro­benzimidazolo[1,2-c]quinazolin-6-yl)aniline methanol solvate
title_sort 2-(5,6-di­hydro­benzimidazolo[1,2-c]quinazolin-6-yl)aniline methanol solvate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2969432/
https://www.ncbi.nlm.nih.gov/pubmed/21582846
http://dx.doi.org/10.1107/S1600536809021886
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