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Benzyl N-[(Z)-(1-methyl-2-sulfanyl­propyl­idene)amino]­carbamodithio­ate.


Break, Mohammed Khaled and Mehta, Sachin and M. Tahir, M. Ibrahim and Crouse, Karen Anne and Khoo, Teng Jin (2013) Benzyl N-[(Z)-(1-methyl-2-sulfanyl­propyl­idene)amino]­carbamodithio­ate. Acta Crystallographica Section E: Structure Reports Online, 69 (pt.2). p. 178. ISSN 1600-5368


The title compound, C12H16N2S3, was obtained by the condensation reaction of S-benzyl dithio­carbazate and 3-mercaptobutan-2-one. The phenyl ring and thiol (SH) group are approximately perpendicular [S—C—C—C and N—C—C—S torsion angles = 67.8 (3) and 116.9 (2)°, respectively] to the rest of the mol­ecule. In the crystal, mol­ecules are linked by weak S—H(...)S and N—H(...)S hydrogen bonds, π–π inter­actions between the benzene rings [centroid–centroid distance = 3.823 (2) Å] and C—H(...)π inter­actions.

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Additional Metadata

Item Type: Article
Divisions: Faculty of Science
DOI Number: https://doi.org/10.1107/S1600536812051008
Publisher: International Union of Crystallography
Keywords: Single-crystal X-ray study; Data-to-parameter ratio = 16.9; R factor = 0.044.
Depositing User: Umikalthom Abdullah
Date Deposited: 30 May 2014 03:23
Last Modified: 24 Aug 2015 06:35
Altmetrics: http://www.altmetric.com/details.php?domain=psasir.upm.edu.my&doi=10.1107/S1600536812051008
URI: http://psasir.upm.edu.my/id/eprint/30000
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