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Benzyl 3-[(E)-2-nitro-benzyl-idene]dithio-carbazate.


ABSTRACT: The title compound, C(15)H(13)N(3)O(2)S(2), was obtained from a condensation reaction of benzyl dithio-carbazate and 2-nitro-benzaldehyde. In the mol-ecule, the nearly planar dithio-carbazate fragment [r.m.s deviation = 0.0264?Å] is oriented at dihedral angles of 7.25?(17) and 74.09?(9)°with respect to the two benzene rings. The nitro group is twisted by a dihedral angle of 22.4?(7)° to the attached benzene ring. The nitro-benzene ring and dithio-carbazate fragment are located on the opposite sides of the C=N bond, showing an E configuration. In the crystal, mol-ecules are linked via inter-molecular N-H?S hydrogen bonds, forming centrosymmetric supra-molecular dimers. Weak C-H?? inter-action is also observed in the crystal structure.

SUBMITTER: Shan S 

PROVIDER: S-EPMC3213549 | biostudies-literature | 2011 Aug

REPOSITORIES: biostudies-literature

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Benzyl 3-[(E)-2-nitro-benzyl-idene]dithio-carbazate.

Shan Shang S   Huang Yan-Lan YL   Guo Han-Qi HQ   Li Deng-Feng DF   Sun Jian J  

Acta crystallographica. Section E, Structure reports online 20110723 Pt 8


The title compound, C(15)H(13)N(3)O(2)S(2), was obtained from a condensation reaction of benzyl dithio-carbazate and 2-nitro-benzaldehyde. In the mol-ecule, the nearly planar dithio-carbazate fragment [r.m.s deviation = 0.0264 Å] is oriented at dihedral angles of 7.25 (17) and 74.09 (9)°with respect to the two benzene rings. The nitro group is twisted by a dihedral angle of 22.4 (7)° to the attached benzene ring. The nitro-benzene ring and dithio-carbazate fragment are located on the opposite si  ...[more]

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