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1-{5-[2-Chloro-5-(trifluoro­meth­yl)phen­yl]thio­phen-2-yl}ethanone

In the title molecule, C(13)H(8)ClF(3)OS, the dihedral angle between the mean planes of 2-chloro-5-(trifluoro­meth­yl)phenyl and tiophene rings is 54.37 (5)°. The acethyl group is twisted by 8.1 (2)° with respect to the thio­phene ring. The CF(3) group is disordered over two sets of sites with occup...

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Autores principales: Lytvyn, Roman, Horak, Yuri, Matiychuk, Vasyl, Obushak, Mykola, Kinzhybalo, Vasyl
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3052071/
https://www.ncbi.nlm.nih.gov/pubmed/21522346
http://dx.doi.org/10.1107/S1600536811003965
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author Lytvyn, Roman
Horak, Yuri
Matiychuk, Vasyl
Obushak, Mykola
Kinzhybalo, Vasyl
author_facet Lytvyn, Roman
Horak, Yuri
Matiychuk, Vasyl
Obushak, Mykola
Kinzhybalo, Vasyl
author_sort Lytvyn, Roman
collection PubMed
description In the title molecule, C(13)H(8)ClF(3)OS, the dihedral angle between the mean planes of 2-chloro-5-(trifluoro­meth­yl)phenyl and tiophene rings is 54.37 (5)°. The acethyl group is twisted by 8.1 (2)° with respect to the thio­phene ring. The CF(3) group is disordered over two sets of sites with occupations of 0.49 (3) and 0.51 (3). The crystal packing features C—H⋯F and C—H⋯O hydrogen bonds, forming dimers which are connected into chains along the c axis by C—H⋯O hydrogen bonds and C—Cl⋯π [Cl⋯π = 3.415 (1) Å and C—Cl⋯π = 151.56 (5)°] inter­actions. The chains are further connected into layers perpendicular to the a axis by C—H⋯O inter­actions.
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spelling pubmed-30520712011-04-26 1-{5-[2-Chloro-5-(trifluoro­meth­yl)phen­yl]thio­phen-2-yl}ethanone Lytvyn, Roman Horak, Yuri Matiychuk, Vasyl Obushak, Mykola Kinzhybalo, Vasyl Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title molecule, C(13)H(8)ClF(3)OS, the dihedral angle between the mean planes of 2-chloro-5-(trifluoro­meth­yl)phenyl and tiophene rings is 54.37 (5)°. The acethyl group is twisted by 8.1 (2)° with respect to the thio­phene ring. The CF(3) group is disordered over two sets of sites with occupations of 0.49 (3) and 0.51 (3). The crystal packing features C—H⋯F and C—H⋯O hydrogen bonds, forming dimers which are connected into chains along the c axis by C—H⋯O hydrogen bonds and C—Cl⋯π [Cl⋯π = 3.415 (1) Å and C—Cl⋯π = 151.56 (5)°] inter­actions. The chains are further connected into layers perpendicular to the a axis by C—H⋯O inter­actions. International Union of Crystallography 2011-02-09 /pmc/articles/PMC3052071/ /pubmed/21522346 http://dx.doi.org/10.1107/S1600536811003965 Text en © Lytvyn 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
Lytvyn, Roman
Horak, Yuri
Matiychuk, Vasyl
Obushak, Mykola
Kinzhybalo, Vasyl
1-{5-[2-Chloro-5-(trifluoro­meth­yl)phen­yl]thio­phen-2-yl}ethanone
title 1-{5-[2-Chloro-5-(trifluoro­meth­yl)phen­yl]thio­phen-2-yl}ethanone
title_full 1-{5-[2-Chloro-5-(trifluoro­meth­yl)phen­yl]thio­phen-2-yl}ethanone
title_fullStr 1-{5-[2-Chloro-5-(trifluoro­meth­yl)phen­yl]thio­phen-2-yl}ethanone
title_full_unstemmed 1-{5-[2-Chloro-5-(trifluoro­meth­yl)phen­yl]thio­phen-2-yl}ethanone
title_short 1-{5-[2-Chloro-5-(trifluoro­meth­yl)phen­yl]thio­phen-2-yl}ethanone
title_sort 1-{5-[2-chloro-5-(trifluoro­meth­yl)phen­yl]thio­phen-2-yl}ethanone
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3052071/
https://www.ncbi.nlm.nih.gov/pubmed/21522346
http://dx.doi.org/10.1107/S1600536811003965
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