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Crystal structures of (E)-4-[1-(2-carbamo-thio-yl-hydrazinyl-idene)eth-yl]phenyl acetate and (E)-4-[1-(2-carbamo-thio-ylhydrazinyl-idene)eth-yl]phenyl benzoate.


ABSTRACT: In the title compounds, C11H13N3O2S, (I), and C16H15N3O2S, (II), the thio-semicarbazone group adopts an extended conformation. The acetate ester (I) crystallizes with two independent mol-ecules in the asymmetric unit. In the benzoate ester (II), the planes of the two aryl rings are inclined to one another by 46.70?(7)°. In both compounds, there is a short intra-molecular N-H?N contact present, forming an S(5) ring motif. In the crystals of both compounds, mol-ecules are linked via pairs of N-H?S hydrogen bonds, forming dimers with R22(8) ring motifs. The dimers are linked by N-H?S and N-H?O hydrogen bonds, forming slabs parallel to (01-1). In (I), there are N-H?? and C-H?? inter-actions present within the slabs, while in (II), there are only N-H?? inter-actions present.

SUBMITTER: Viswanathan V 

PROVIDER: S-EPMC5209762 | biostudies-literature | 2017 Jan

REPOSITORIES: biostudies-literature

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Crystal structures of (<i>E</i>)-4-[1-(2-carbamo-thio-yl-hydrazinyl-idene)eth-yl]phenyl acetate and (<i>E</i>)-4-[1-(2-carbamo-thio-ylhydrazinyl-idene)eth-yl]phenyl benzoate.

Viswanathan Vijayan V   Ananth Mani Karthik MK   Narasimhan S S   Velmurugan Devadasan D  

Acta crystallographica. Section E, Crystallographic communications 20170101 Pt 1


In the title compounds, C<sub>11</sub>H<sub>13</sub>N<sub>3</sub>O<sub>2</sub>S, (I), and C<sub>16</sub>H<sub>15</sub>N<sub>3</sub>O<sub>2</sub>S, (II), the thio-semicarbazone group adopts an extended conformation. The acetate ester (I) crystallizes with two independent mol-ecules in the asymmetric unit. In the benzoate ester (II), the planes of the two aryl rings are inclined to one another by 46.70 (7)°. In both compounds, there is a short intra-molecular N-H⋯N contact present, forming an <i>S  ...[more]

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