2,2′-(Disulfanediyl)dibenzoic acid N,N-dimethylformamide monosolvate: crystal structure, Hirshfeld surface analysis and computational study

2,2′-(Disulfanediyl)dibenzoic acid N,N-dimethylformamide monosolvate: crystal structure, Hirshfeld surface analysis and computational study

The title 1:1 solvate, C14H10O4S2·C3H7NO, features a twisted molecule of 2,2′-dithiodibenzoic acid (DTBA), with the central C—S—S—C torsion angle being −88.57 (6)°, and a molecule of dimethylformamide (DMF). The carboxylic acid groups are, respectively, close to co-planar and twisted with respect to...

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Bibliographic Details
Main Authors: Sang Loon Tan, Edward R. T. Tiekink
Format: Article
Language:English
Published: International Union of Crystallography 2020-07-01
Series:Acta Crystallographica Section E: Crystallographic Communications
Subjects:
crystal structure
2,2′-dithiodibenzoic acid
dimethylformamide
hydrogen bonding
hirshfeld surface analysis
computational chemistry
Online Access:http://scripts.iucr.org/cgi-bin/paper?S2056989020008257

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http://scripts.iucr.org/cgi-bin/paper?S2056989020008257

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