N-(4-Chloro­phen­yl)-1,1,1-trifluoro-N-(trifluoro­methyl­sulfon­yl)methane­sulfonamide

The title mol­ecule, also called 4-chloro-N,N-bis­(trifluoro­methane­sulfon­yl)aniline, C(8)H(4)ClF(6)NO(4)S(2), has non-crystallographic twofold symmetry with the pseudo-axis aligned along the Cl—C⋯C—N backbone of the mol­ecule: the SO(2)CF(3) residues lie to either side of the benzene ring. In the...

Descripción completa

Detalles Bibliográficos
Autores principales: Boechat, Núbia, dos Santos Lages, Adriana, Kover, Warner B., Tiekink, Edward R. T., Wardell, James L., Wardell, Solange M. S. V.
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2983512/
https://www.ncbi.nlm.nih.gov/pubmed/21580282
http://dx.doi.org/10.1107/S1600536810003326
_version_ 1782191889940742144
author Boechat, Núbia
dos Santos Lages, Adriana
Kover, Warner B.
Tiekink, Edward R. T.
Wardell, James L.
Wardell, Solange M. S. V.
author_facet Boechat, Núbia
dos Santos Lages, Adriana
Kover, Warner B.
Tiekink, Edward R. T.
Wardell, James L.
Wardell, Solange M. S. V.
author_sort Boechat, Núbia
collection PubMed
description The title mol­ecule, also called 4-chloro-N,N-bis­(trifluoro­methane­sulfon­yl)aniline, C(8)H(4)ClF(6)NO(4)S(2), has non-crystallographic twofold symmetry with the pseudo-axis aligned along the Cl—C⋯C—N backbone of the mol­ecule: the SO(2)CF(3) residues lie to either side of the benzene ring. In the crystal, the presence of C—H⋯O contacts lead to the formation of a sequence of 12-membered {⋯HC(2)NSO}(2) synthons within a supra­molecular chain aligned along [101].
format Text
id pubmed-2983512
institution National Center for Biotechnology Information
language English
publishDate 2010
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-29835122010-12-30 N-(4-Chloro­phen­yl)-1,1,1-trifluoro-N-(trifluoro­methyl­sulfon­yl)methane­sulfonamide Boechat, Núbia dos Santos Lages, Adriana Kover, Warner B. Tiekink, Edward R. T. Wardell, James L. Wardell, Solange M. S. V. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title mol­ecule, also called 4-chloro-N,N-bis­(trifluoro­methane­sulfon­yl)aniline, C(8)H(4)ClF(6)NO(4)S(2), has non-crystallographic twofold symmetry with the pseudo-axis aligned along the Cl—C⋯C—N backbone of the mol­ecule: the SO(2)CF(3) residues lie to either side of the benzene ring. In the crystal, the presence of C—H⋯O contacts lead to the formation of a sequence of 12-membered {⋯HC(2)NSO}(2) synthons within a supra­molecular chain aligned along [101]. International Union of Crystallography 2010-02-03 /pmc/articles/PMC2983512/ /pubmed/21580282 http://dx.doi.org/10.1107/S1600536810003326 Text en © Boechat et al. 2010 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
Boechat, Núbia
dos Santos Lages, Adriana
Kover, Warner B.
Tiekink, Edward R. T.
Wardell, James L.
Wardell, Solange M. S. V.
N-(4-Chloro­phen­yl)-1,1,1-trifluoro-N-(trifluoro­methyl­sulfon­yl)methane­sulfonamide
title N-(4-Chloro­phen­yl)-1,1,1-trifluoro-N-(trifluoro­methyl­sulfon­yl)methane­sulfonamide
title_full N-(4-Chloro­phen­yl)-1,1,1-trifluoro-N-(trifluoro­methyl­sulfon­yl)methane­sulfonamide
title_fullStr N-(4-Chloro­phen­yl)-1,1,1-trifluoro-N-(trifluoro­methyl­sulfon­yl)methane­sulfonamide
title_full_unstemmed N-(4-Chloro­phen­yl)-1,1,1-trifluoro-N-(trifluoro­methyl­sulfon­yl)methane­sulfonamide
title_short N-(4-Chloro­phen­yl)-1,1,1-trifluoro-N-(trifluoro­methyl­sulfon­yl)methane­sulfonamide
title_sort n-(4-chloro­phen­yl)-1,1,1-trifluoro-n-(trifluoro­methyl­sulfon­yl)methane­sulfonamide
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2983512/
https://www.ncbi.nlm.nih.gov/pubmed/21580282
http://dx.doi.org/10.1107/S1600536810003326
work_keys_str_mv AT boechatnubia n4chlorophenyl111trifluorontrifluoromethylsulfonylmethanesulfonamide
AT dossantoslagesadriana n4chlorophenyl111trifluorontrifluoromethylsulfonylmethanesulfonamide
AT koverwarnerb n4chlorophenyl111trifluorontrifluoromethylsulfonylmethanesulfonamide
AT tiekinkedwardrt n4chlorophenyl111trifluorontrifluoromethylsulfonylmethanesulfonamide
AT wardelljamesl n4chlorophenyl111trifluorontrifluoromethylsulfonylmethanesulfonamide
AT wardellsolangemsv n4chlorophenyl111trifluorontrifluoromethylsulfonylmethanesulfonamide

Ejemplares similares