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Crystal structure of N-(2-{[2,6-bis(2,2,2-trifluoroacetamido)phenyl]disulfanyl}-3-(2,2,2-trifluoroacetamido)phenyl)-2,2,2-trifluoroacetamide
The title compound, C(20)H(10)F(12)N(4)O(4)S(2), is an organic diaryl disulfide compound with trifluoroacetamide substituents at the ortho-positions of each benzene ring. There are two molecules (labeled A and B) in the asymmetric unit. The F atoms of three of the –CF(3) groups exhibit rotationa...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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International Union of Crystallography
2015
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4555375/ https://www.ncbi.nlm.nih.gov/pubmed/26396879 http://dx.doi.org/10.1107/S2056989015014231 |
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author | Awasabisah, Dennis Powell, Douglas R. Richter-Addo, George B. |
author_facet | Awasabisah, Dennis Powell, Douglas R. Richter-Addo, George B. |
author_sort | Awasabisah, Dennis |
collection | PubMed |
description | The title compound, C(20)H(10)F(12)N(4)O(4)S(2), is an organic diaryl disulfide compound with trifluoroacetamide substituents at the ortho-positions of each benzene ring. There are two molecules (labeled A and B) in the asymmetric unit. The F atoms of three of the –CF(3) groups exhibit rotational disorder over two positions each. The S—S bond distances are 2.0914 (7) and 2.0827 (6) Å for molecules A and B, respectively. The dihedral angle between the S—S—C and S—C—C planes is 103.05 (15)° for molecule A and 104.09 (15)° for molecule B. The three-dimensional supramolecular architecture of the crystal is sustained by numerous N—H⋯O, N—H⋯S and C—H⋯O interactions. |
format | Online Article Text |
id | pubmed-4555375 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2015 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-45553752015-09-22 Crystal structure of N-(2-{[2,6-bis(2,2,2-trifluoroacetamido)phenyl]disulfanyl}-3-(2,2,2-trifluoroacetamido)phenyl)-2,2,2-trifluoroacetamide Awasabisah, Dennis Powell, Douglas R. Richter-Addo, George B. Acta Crystallogr E Crystallogr Commun Data Reports The title compound, C(20)H(10)F(12)N(4)O(4)S(2), is an organic diaryl disulfide compound with trifluoroacetamide substituents at the ortho-positions of each benzene ring. There are two molecules (labeled A and B) in the asymmetric unit. The F atoms of three of the –CF(3) groups exhibit rotational disorder over two positions each. The S—S bond distances are 2.0914 (7) and 2.0827 (6) Å for molecules A and B, respectively. The dihedral angle between the S—S—C and S—C—C planes is 103.05 (15)° for molecule A and 104.09 (15)° for molecule B. The three-dimensional supramolecular architecture of the crystal is sustained by numerous N—H⋯O, N—H⋯S and C—H⋯O interactions. International Union of Crystallography 2015-08-06 /pmc/articles/PMC4555375/ /pubmed/26396879 http://dx.doi.org/10.1107/S2056989015014231 Text en © Awasabisah 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 Awasabisah, Dennis Powell, Douglas R. Richter-Addo, George B. Crystal structure of N-(2-{[2,6-bis(2,2,2-trifluoroacetamido)phenyl]disulfanyl}-3-(2,2,2-trifluoroacetamido)phenyl)-2,2,2-trifluoroacetamide |
title | Crystal structure of N-(2-{[2,6-bis(2,2,2-trifluoroacetamido)phenyl]disulfanyl}-3-(2,2,2-trifluoroacetamido)phenyl)-2,2,2-trifluoroacetamide |
title_full | Crystal structure of N-(2-{[2,6-bis(2,2,2-trifluoroacetamido)phenyl]disulfanyl}-3-(2,2,2-trifluoroacetamido)phenyl)-2,2,2-trifluoroacetamide |
title_fullStr | Crystal structure of N-(2-{[2,6-bis(2,2,2-trifluoroacetamido)phenyl]disulfanyl}-3-(2,2,2-trifluoroacetamido)phenyl)-2,2,2-trifluoroacetamide |
title_full_unstemmed | Crystal structure of N-(2-{[2,6-bis(2,2,2-trifluoroacetamido)phenyl]disulfanyl}-3-(2,2,2-trifluoroacetamido)phenyl)-2,2,2-trifluoroacetamide |
title_short | Crystal structure of N-(2-{[2,6-bis(2,2,2-trifluoroacetamido)phenyl]disulfanyl}-3-(2,2,2-trifluoroacetamido)phenyl)-2,2,2-trifluoroacetamide |
title_sort | crystal structure of n-(2-{[2,6-bis(2,2,2-trifluoroacetamido)phenyl]disulfanyl}-3-(2,2,2-trifluoroacetamido)phenyl)-2,2,2-trifluoroacetamide |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4555375/ https://www.ncbi.nlm.nih.gov/pubmed/26396879 http://dx.doi.org/10.1107/S2056989015014231 |
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