3-(4-Nitrophenyl)-1H-1,2,4-triazole-5(4H)-thione

In the title compound, C8H6N4O2S, the 1,2,4-triazole ring and the nitro group form dihedral angles of 6.26 (13) and 9.5 (3)°, respectively, with the phenyl ring. In the crystal, the molecules are linked via pairs of N—H...S hydrogen bonds, gener...

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Bibliographic Details
Main Authors: Hoong-Kun Fun, Ching Kheng Quah, Nithinchandra, Balakrishna Kalluraya
Format: Article
Language:English
Published: International Union of Crystallography 2011-09-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536811033952
Description
Summary:In the title compound, C8H6N4O2S, the 1,2,4-triazole ring and the nitro group form dihedral angles of 6.26 (13) and 9.5 (3)°, respectively, with the phenyl ring. In the crystal, the molecules are linked via pairs of N—H...S hydrogen bonds, generating [010] chains which contain R22 (8) ring motifs. The crystal structure is further stabilized by π–π stacking [centroid–centroid distance = 3.5491 (14) Å] interactions.
ISSN:1600-5368