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Crystal structure of N-(2-{[2,6-bis-(2,2,2-tri-fluoro-acetamido)-phen-yl]disulfan-yl}-3-(2,2,2-tri-fluoro-acetamido)-phen-yl)-2,2,2-tri-fluoro-acetamide.


ABSTRACT: The title compound, C20H10F12N4O4S2, is an organic diaryl di-sulfide compound with tri-fluoro-acetamide substituents at the ortho-positions of each benzene ring. There are two mol-ecules (labeled A and B) in the asymmetric unit. The F atoms of three of the -CF3 groups exhibit rotational disorder over two positions each. The S-S bond distances are 2.0914?(7) and 2.0827?(6)?Å for mol-ecules A and B, respectively. The dihedral angle between the S-S-C and S-C-C planes is 103.05?(15)° for mol-ecule A and 104.09?(15)° for mol-ecule B. The three-dimensional supra-molecular architecture of the crystal is sustained by numerous N-H?O, N-H?S and C-H?O inter-actions.

SUBMITTER: Awasabisah D 

PROVIDER: S-EPMC4555375 | biostudies-literature | 2015 Sep

REPOSITORIES: biostudies-literature

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Crystal structure of N-(2-{[2,6-bis-(2,2,2-tri-fluoro-acetamido)-phen-yl]disulfan-yl}-3-(2,2,2-tri-fluoro-acetamido)-phen-yl)-2,2,2-tri-fluoro-acetamide.

Awasabisah Dennis D   Powell Douglas R DR   Richter-Addo George B GB  

Acta crystallographica. Section E, Crystallographic communications 20150806 Pt 9


The title compound, C20H10F12N4O4S2, is an organic diaryl di-sulfide compound with tri-fluoro-acetamide substituents at the ortho-positions of each benzene ring. There are two mol-ecules (labeled A and B) in the asymmetric unit. The F atoms of three of the -CF3 groups exhibit rotational disorder over two positions each. The S-S bond distances are 2.0914 (7) and 2.0827 (6) Å for mol-ecules A and B, respectively. The dihedral angle between the S-S-C and S-C-C planes is 103.05 (15)° for mol-ecule A  ...[more]

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