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Crystal structure of [4-(chloro­meth­yl)phen­yl](4-hy­droxy­piperidin-1-yl)methanone

The title compound, C(13)H(16)ClNO(2), crystallized with two independent mol­ecules in the asymmetric unit (A and B). The piperidinol ring in mol­ecule B is disordered over two positions with a site occupancy ratio of 0.667 (5):0.333 (5). In both mol­ecules these rings have a chair conformation, inc...

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Autores principales: Revathi, B. K., Reuben Jonathan, D., Kalai Sevi, K., Dhanalakshmi, K., Usha, G.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4647401/
https://www.ncbi.nlm.nih.gov/pubmed/26594432
http://dx.doi.org/10.1107/S2056989015016096
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author Revathi, B. K.
Reuben Jonathan, D.
Kalai Sevi, K.
Dhanalakshmi, K.
Usha, G.
author_facet Revathi, B. K.
Reuben Jonathan, D.
Kalai Sevi, K.
Dhanalakshmi, K.
Usha, G.
author_sort Revathi, B. K.
collection PubMed
description The title compound, C(13)H(16)ClNO(2), crystallized with two independent mol­ecules in the asymmetric unit (A and B). The piperidinol ring in mol­ecule B is disordered over two positions with a site occupancy ratio of 0.667 (5):0.333 (5). In both mol­ecules these rings have a chair conformation, including the minor component in mol­ecule B. Their mean planes are inclined to the benzene ring by 45.57 (13)° in mol­ecule A, and by 50.5 (4)° for the major component of the piperidine ring in mol­ecule B. In the crystal, the individual mol­ecules are linked by O—H⋯O hydrogen bonds, forming chains of A and B mol­ecules along the [100] direction. The chains are inter­linked by C—H⋯O hydrogen bonds, forming ribbons.
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spelling pubmed-46474012015-11-20 Crystal structure of [4-(chloro­meth­yl)phen­yl](4-hy­droxy­piperidin-1-yl)methanone Revathi, B. K. Reuben Jonathan, D. Kalai Sevi, K. Dhanalakshmi, K. Usha, G. Acta Crystallogr E Crystallogr Commun Data Reports The title compound, C(13)H(16)ClNO(2), crystallized with two independent mol­ecules in the asymmetric unit (A and B). The piperidinol ring in mol­ecule B is disordered over two positions with a site occupancy ratio of 0.667 (5):0.333 (5). In both mol­ecules these rings have a chair conformation, including the minor component in mol­ecule B. Their mean planes are inclined to the benzene ring by 45.57 (13)° in mol­ecule A, and by 50.5 (4)° for the major component of the piperidine ring in mol­ecule B. In the crystal, the individual mol­ecules are linked by O—H⋯O hydrogen bonds, forming chains of A and B mol­ecules along the [100] direction. The chains are inter­linked by C—H⋯O hydrogen bonds, forming ribbons. International Union of Crystallography 2015-09-12 /pmc/articles/PMC4647401/ /pubmed/26594432 http://dx.doi.org/10.1107/S2056989015016096 Text en © Revathi 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
Revathi, B. K.
Reuben Jonathan, D.
Kalai Sevi, K.
Dhanalakshmi, K.
Usha, G.
Crystal structure of [4-(chloro­meth­yl)phen­yl](4-hy­droxy­piperidin-1-yl)methanone
title Crystal structure of [4-(chloro­meth­yl)phen­yl](4-hy­droxy­piperidin-1-yl)methanone
title_full Crystal structure of [4-(chloro­meth­yl)phen­yl](4-hy­droxy­piperidin-1-yl)methanone
title_fullStr Crystal structure of [4-(chloro­meth­yl)phen­yl](4-hy­droxy­piperidin-1-yl)methanone
title_full_unstemmed Crystal structure of [4-(chloro­meth­yl)phen­yl](4-hy­droxy­piperidin-1-yl)methanone
title_short Crystal structure of [4-(chloro­meth­yl)phen­yl](4-hy­droxy­piperidin-1-yl)methanone
title_sort crystal structure of [4-(chloro­meth­yl)phen­yl](4-hy­droxy­piperidin-1-yl)methanone
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4647401/
https://www.ncbi.nlm.nih.gov/pubmed/26594432
http://dx.doi.org/10.1107/S2056989015016096
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