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7-Chloro-3-phenyl-benzo[4,5]thia-zolo[2,3-c][1,2,4]triazole.

ABSTRACT: In the title compound, C(14)H(8)ClN(3)S, the dihedral angle between the approximately planar triple-fused ring system (r.m.s. deviation = 0.065?Å) and the pendant phenyl ring is 62.25?(5)°. In the crystal, mol-ecules are linked into infinite chains along the c-axis direction by C-H?N hydrogen bonds. Aromatic ?-? stacking inter-actions [centroid-centroid distances = 3.7499?(8) and 3.5644?(8)?Å] and weak C-H?? inter-actions are also observed.

SUBMITTER: Fun HK

PROVIDER: S-EPMC3201329 | biostudies-literature | 2011 Oct

REPOSITORIES: biostudies-literature

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7-Chloro-3-phenyl-benzo[4,5]thia-zolo[2,3-c][1,2,4]triazole.

Fun Hoong-Kun HK Asik Safra Izuani Jama SI Himaja M M Munirajasekhar D D Sarojini B K BK

Acta crystallographica. Section E, Structure reports online 20110930 Pt 10

In the title compound, C(14)H(8)ClN(3)S, the dihedral angle between the approximately planar triple-fused ring system (r.m.s. deviation = 0.065 Å) and the pendant phenyl ring is 62.25 (5)°. In the crystal, mol-ecules are linked into infinite chains along the c-axis direction by C-H⋯N hydrogen bonds. Aromatic π-π stacking inter-actions [centroid-centroid distances = 3.7499 (8) and 3.5644 (8) Å] and weak C-H⋯π inter-actions are also observed. ...[more]

PMID: 22058831

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