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2-(1H-Benzoimidazol-2-yl)-6-ethoxyphenol
The title Schiff base compound, C(15)H(14)N(2)O(2), consists of two crystallographically independent molecules, A and B. Molecule A is almost planar, whereas molecule B is slightly twisted, the dihedral angles between the benzimidazole group and the benzene rings being 2.65 (12) and 13.17 (15)°,...
Autores principales: | , , , , |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2009
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2969036/ https://www.ncbi.nlm.nih.gov/pubmed/21582478 http://dx.doi.org/10.1107/S1600536809008071 |
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author | Yeap, Chin Sing Kargar, Hadi Kia, Reza Jamshidvand, Arezoo Fun, Hoong-Kun |
author_facet | Yeap, Chin Sing Kargar, Hadi Kia, Reza Jamshidvand, Arezoo Fun, Hoong-Kun |
author_sort | Yeap, Chin Sing |
collection | PubMed |
description | The title Schiff base compound, C(15)H(14)N(2)O(2), consists of two crystallographically independent molecules, A and B. Molecule A is almost planar, whereas molecule B is slightly twisted, the dihedral angles between the benzimidazole group and the benzene rings being 2.65 (12) and 13.17 (15)°, respectively. The methyl group of molecule B is disordered over two positions, with a refined site-occupancy ratio of 0.581 (7):0.419 (7). In each molecule, intramolecular O—H⋯N hydrogen bonds generate S(6) ring motifs. In the crystal structure, both types of molecules are linked via intermolecular bifurcated N—H⋯O hydrogen bonds into one-dimensional extended chains along [010] and form R (1) (2)(5) ring motifs. The crystal structure is further stabilized by intermolecular C—H⋯π and π–π interactions [centroid–centroid distances = 3.4758 (16)–3.596 (2) Å]. |
format | Text |
id | pubmed-2969036 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2009 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29690362010-12-30 2-(1H-Benzoimidazol-2-yl)-6-ethoxyphenol Yeap, Chin Sing Kargar, Hadi Kia, Reza Jamshidvand, Arezoo Fun, Hoong-Kun Acta Crystallogr Sect E Struct Rep Online Organic Papers The title Schiff base compound, C(15)H(14)N(2)O(2), consists of two crystallographically independent molecules, A and B. Molecule A is almost planar, whereas molecule B is slightly twisted, the dihedral angles between the benzimidazole group and the benzene rings being 2.65 (12) and 13.17 (15)°, respectively. The methyl group of molecule B is disordered over two positions, with a refined site-occupancy ratio of 0.581 (7):0.419 (7). In each molecule, intramolecular O—H⋯N hydrogen bonds generate S(6) ring motifs. In the crystal structure, both types of molecules are linked via intermolecular bifurcated N—H⋯O hydrogen bonds into one-dimensional extended chains along [010] and form R (1) (2)(5) ring motifs. The crystal structure is further stabilized by intermolecular C—H⋯π and π–π interactions [centroid–centroid distances = 3.4758 (16)–3.596 (2) Å]. International Union of Crystallography 2009-03-14 /pmc/articles/PMC2969036/ /pubmed/21582478 http://dx.doi.org/10.1107/S1600536809008071 Text en © Yeap 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 Yeap, Chin Sing Kargar, Hadi Kia, Reza Jamshidvand, Arezoo Fun, Hoong-Kun 2-(1H-Benzoimidazol-2-yl)-6-ethoxyphenol |
title | 2-(1H-Benzoimidazol-2-yl)-6-ethoxyphenol |
title_full | 2-(1H-Benzoimidazol-2-yl)-6-ethoxyphenol |
title_fullStr | 2-(1H-Benzoimidazol-2-yl)-6-ethoxyphenol |
title_full_unstemmed | 2-(1H-Benzoimidazol-2-yl)-6-ethoxyphenol |
title_short | 2-(1H-Benzoimidazol-2-yl)-6-ethoxyphenol |
title_sort | 2-(1h-benzoimidazol-2-yl)-6-ethoxyphenol |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2969036/ https://www.ncbi.nlm.nih.gov/pubmed/21582478 http://dx.doi.org/10.1107/S1600536809008071 |
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