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1-(4-Chloro-butano-yl)-3-(2-nitro-phen-yl)thio-urea.

ABSTRACT: The asymmetric unit of the title compound, C(11)H(12)ClN(3)O(3)S, contains two independent mol-ecules with different conformations in which the benzene ring and the thio-urea fragment form dihedral angles of 87.28?(12) and 66.44?(10)°. The O atom of the thio-amide group is involved in bifurcated N-H?O intra- and inter-molecular hydrogen bonding; the latter inter-action links the independent mol-ecules into a dimer. In the crystal, N-H?S inter-actions link the mol-ecules into chains propagating along the c axis.

SUBMITTER: Ngah N 

PROVIDER: S-EPMC3379376 | biostudies-literature | 2012 Jun

REPOSITORIES: biostudies-literature

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1-(4-Chloro-butano-yl)-3-(2-nitro-phen-yl)thio-urea.

Ngah Nurziana N   Kadir Maisara M   Yamin Bohari M BM   Yusof M Sukeri M MS  

Acta crystallographica. Section E, Structure reports online 20120519 Pt 6

The asymmetric unit of the title compound, C(11)H(12)ClN(3)O(3)S, contains two independent mol-ecules with different conformations in which the benzene ring and the thio-urea fragment form dihedral angles of 87.28 (12) and 66.44 (10)°. The O atom of the thio-amide group is involved in bifurcated N-H⋯O intra- and inter-molecular hydrogen bonding; the latter inter-action links the independent mol-ecules into a dimer. In the crystal, N-H⋯S inter-actions link the mol-ecules into chains propagating a  ...[more]

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