3-[(E)-(4-Chloro-benzyl-idene)amino]-1-phenyl-thio-urea.

ABSTRACT: In the title compound, C(14)H(12)ClN(3)S, the dihedral angle between the terminal benzene rings is 56.6?(2)°; the benzene rings lie to the same side of the mol-ecule. The major twist in the mol-ecule occurs around the C(ar)-N bond (ar is aromatic) [C-N-C-C = 49.9?(5)°]. The configuration about the N=C bond [1.271?(4)?Å] is E. The amine H atoms lie on opposite sides of the mol-ecule with one forming an intra-molecular N-H?N(imine) hydrogen bond and an S(5) ring. In the crystal, centrosymmetric dimers are formed via {?HNC=S}(2) synthons.

SUBMITTER: Dzulkifli NN 

PROVIDER: S-EPMC3100056 | biostudies-literature | 2011 Apr

REPOSITORIES: biostudies-literature