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Crystal structure of 5-(1-benzofuran-2-yl)-3-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-5-ol
In the title compound, C(18)H(15)NO(3), the isoxazole moiety adopts a shallow envelope conformation, with the C atom bearing the OH group displaced by 0.148 (1) Å from the mean plane through the other four atoms. The mean plane of this ring (all atoms) subtends dihedral angles of 87.19 (6) and 15.51...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2015
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4518973/ https://www.ncbi.nlm.nih.gov/pubmed/26279925 http://dx.doi.org/10.1107/S2056989015011263 |
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author | Ravi, A. J. Vinayaka, A. C. Jeyaseelan, S. Sadashiva, M. P. Devarajegowda, H. C. |
author_facet | Ravi, A. J. Vinayaka, A. C. Jeyaseelan, S. Sadashiva, M. P. Devarajegowda, H. C. |
author_sort | Ravi, A. J. |
collection | PubMed |
description | In the title compound, C(18)H(15)NO(3), the isoxazole moiety adopts a shallow envelope conformation, with the C atom bearing the OH group displaced by 0.148 (1) Å from the mean plane through the other four atoms. The mean plane of this ring (all atoms) subtends dihedral angles of 87.19 (6) and 15.51 (7)° with the benzofuran ring system (r.m.s. deviation = 0.007 Å) and the 4-methylphenyl ring, respectively. In the crystal, molecules are linked by O—H⋯N hydrogen bonds, generating [001] C(5) chains, with adjacent molecules in the chain related by c-glide symmetry. Weak C—H⋯O interactions link the chains into a three-dimensional network. |
format | Online Article Text |
id | pubmed-4518973 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2015 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-45189732015-08-14 Crystal structure of 5-(1-benzofuran-2-yl)-3-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-5-ol Ravi, A. J. Vinayaka, A. C. Jeyaseelan, S. Sadashiva, M. P. Devarajegowda, H. C. Acta Crystallogr E Crystallogr Commun Data Reports In the title compound, C(18)H(15)NO(3), the isoxazole moiety adopts a shallow envelope conformation, with the C atom bearing the OH group displaced by 0.148 (1) Å from the mean plane through the other four atoms. The mean plane of this ring (all atoms) subtends dihedral angles of 87.19 (6) and 15.51 (7)° with the benzofuran ring system (r.m.s. deviation = 0.007 Å) and the 4-methylphenyl ring, respectively. In the crystal, molecules are linked by O—H⋯N hydrogen bonds, generating [001] C(5) chains, with adjacent molecules in the chain related by c-glide symmetry. Weak C—H⋯O interactions link the chains into a three-dimensional network. International Union of Crystallography 2015-06-17 /pmc/articles/PMC4518973/ /pubmed/26279925 http://dx.doi.org/10.1107/S2056989015011263 Text en © Ravi et al. 2015 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 | Data Reports Ravi, A. J. Vinayaka, A. C. Jeyaseelan, S. Sadashiva, M. P. Devarajegowda, H. C. Crystal structure of 5-(1-benzofuran-2-yl)-3-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-5-ol |
title | Crystal structure of 5-(1-benzofuran-2-yl)-3-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-5-ol |
title_full | Crystal structure of 5-(1-benzofuran-2-yl)-3-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-5-ol |
title_fullStr | Crystal structure of 5-(1-benzofuran-2-yl)-3-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-5-ol |
title_full_unstemmed | Crystal structure of 5-(1-benzofuran-2-yl)-3-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-5-ol |
title_short | Crystal structure of 5-(1-benzofuran-2-yl)-3-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-5-ol |
title_sort | crystal structure of 5-(1-benzofuran-2-yl)-3-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-5-ol |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4518973/ https://www.ncbi.nlm.nih.gov/pubmed/26279925 http://dx.doi.org/10.1107/S2056989015011263 |
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