Methyl 2-[4-(trifluoromethyl)phenylsulfanyl]benzoate

Methyl 2-[4-(trifluoromethyl)phenylsulfanyl]benzoate

In the title compound, C15H13F3O2S, the dihedral angle between the benzene rings is 79.5 (1)°. The ester group is twisted by 7.6 (1)° from the mean plane of the adjacent benzene ring. Disorder was modeled over two sites for one F atom of the trifluoromethyl grou...

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Main Authors: Thammarse S. Yamuna, Jerry P. Jasinski, Brian J. Anderson, H. S. Yathirajan, Manpreet Kaur
Format: Article
Language:English
Published: International Union of Crystallography 2013-11-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536813028146
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spelling doaj-e2398306c1814c7ca00bc03bb92f17f92020-11-24T21:56:39ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682013-11-016911o1670o167010.1107/S1600536813028146Methyl 2-[4-(trifluoromethyl)phenylsulfanyl]benzoateThammarse S. YamunaJerry P. JasinskiBrian J. AndersonH. S. YathirajanManpreet KaurIn the title compound, C15H13F3O2S, the dihedral angle between the benzene rings is 79.5 (1)°. The ester group is twisted by 7.6 (1)° from the mean plane of the adjacent benzene ring. Disorder was modeled over two sites for one F atom of the trifluoromethyl group with an occupancy ratio of 0.54 (6):0.46 (6). In the crystal, molecules are linked via weak C—H...O hydrogen bonds, forming two-dimensional networks lying parallel to (101). The networks are linked via C—H...π interactions, leading to the formation of a three-dimensional supramolecular structure.http://scripts.iucr.org/cgi-bin/paper?S1600536813028146
collection DOAJ
language English
format Article
sources DOAJ
author Thammarse S. Yamuna
Jerry P. Jasinski
Brian J. Anderson
H. S. Yathirajan
Manpreet Kaur
spellingShingle Thammarse S. Yamuna
Jerry P. Jasinski
Brian J. Anderson
H. S. Yathirajan
Manpreet Kaur
Methyl 2-[4-(trifluoromethyl)phenylsulfanyl]benzoate
Acta Crystallographica Section E
author_facet Thammarse S. Yamuna
Jerry P. Jasinski
Brian J. Anderson
H. S. Yathirajan
Manpreet Kaur
author_sort Thammarse S. Yamuna
title Methyl 2-[4-(trifluoromethyl)phenylsulfanyl]benzoate
title_short Methyl 2-[4-(trifluoromethyl)phenylsulfanyl]benzoate
title_full Methyl 2-[4-(trifluoromethyl)phenylsulfanyl]benzoate
title_fullStr Methyl 2-[4-(trifluoromethyl)phenylsulfanyl]benzoate
title_full_unstemmed Methyl 2-[4-(trifluoromethyl)phenylsulfanyl]benzoate
title_sort methyl 2-[4-(trifluoromethyl)phenylsulfanyl]benzoate
publisher International Union of Crystallography
series Acta Crystallographica Section E
issn 1600-5368
publishDate 2013-11-01
description In the title compound, C15H13F3O2S, the dihedral angle between the benzene rings is 79.5 (1)°. The ester group is twisted by 7.6 (1)° from the mean plane of the adjacent benzene ring. Disorder was modeled over two sites for one F atom of the trifluoromethyl group with an occupancy ratio of 0.54 (6):0.46 (6). In the crystal, molecules are linked via weak C—H...O hydrogen bonds, forming two-dimensional networks lying parallel to (101). The networks are linked via C—H...π interactions, leading to the formation of a three-dimensional supramolecular structure.
url http://scripts.iucr.org/cgi-bin/paper?S1600536813028146
work_keys_str_mv AT thammarsesyamuna methyl24trifluoromethylphenylsulfanylbenzoate
AT jerrypjasinski methyl24trifluoromethylphenylsulfanylbenzoate
AT brianjanderson methyl24trifluoromethylphenylsulfanylbenzoate
AT hsyathirajan methyl24trifluoromethylphenylsulfanylbenzoate
AT manpreetkaur methyl24trifluoromethylphenylsulfanylbenzoate
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