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Isolation, characterization and x-ray structure determination of 2,5-bis(4-methylbenzylthio)-1,3,4-thiadiazole


Citation

Tayamon, Shahedeh and Tiekink, Edward R. T. and Nikpour, Farzad and S. A. Ravoof, Thahira Begum and Mohamed Tahir, Mohamad Ibrahim and Karen, Anne Crouse (2014) Isolation, characterization and x-ray structure determination of 2,5-bis(4-methylbenzylthio)-1,3,4-thiadiazole. Journal of Chemical Crystallography , 44 (1). pp. 1-5. ISSN 1074-1542; ESSN: 1572-8854

Abstract

The reaction of hydrazine hydrate with carbon disulfide and 4-methylbenzyl chloride in basic solution yielded 2,5-bis(4-methylbenzylthio)-1,3,4-thiadiazole (C18H18N2S3, compound 1) in addition to the expected S-4-methylbenzyldithiocarbazate. The molecule has approximate twofold symmetry with the C=S bond lying on the pseudo axis. The five membered ring is planar with the three S atoms mutually syn, and with pendent 4-methylbenzylthio substituents; the dihedral angle between the terminal rings is 52.21(7)°. The compound 1 crystallizes in the triclinic space group \(P\bar{1}\) with a = 6.0139(3) Å, b = 11.8694(7) Å, c = 12.6330(7) Å, α = 72.583(5)°, β = 82.827(4)°, γ = 89.882(4)° and Z = 2.


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Additional Metadata

Item Type: Article
Divisions: Faculty of Science
DOI Number: https://doi.org/10.1007/s10870-013-0474-2
Publisher: Springer
Keywords: Dithiocarbazate; 1,3,4-thiadiazole; Supramolecular structure; Crystal structure
Depositing User: Nurul Ainie Mokhtar
Date Deposited: 10 Dec 2015 03:37
Last Modified: 10 Dec 2015 03:37
Altmetrics: http://www.altmetric.com/details.php?domain=psasir.upm.edu.my&doi=10.1007/s10870-013-0474-2
URI: http://psasir.upm.edu.my/id/eprint/34293
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