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4-Benzyl-1-p-tolyl-1H-1,2,4-triazol-5(4H)-one.

ABSTRACT: In the title compound, C(16)H(15)N(3)O, the triazole ring makes dihedral angles of 7.08?(2) and 74.53?(3)° with the two outer aromatic rings. The crystal packing is stabilized by very short inter-molecular C-H?O hydrogen bonds and weak ?-? stacking inter-actions [centroid-to-centroid distance 3.632?(3)?Å], resulting in the formation of zigzag chains parallel to the b axis.

SUBMITTER: Zhu YJ

PROVIDER: S-EPMC2968189 | biostudies-literature | 2009 Jan

REPOSITORIES: biostudies-literature

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4-Benzyl-1-p-tolyl-1H-1,2,4-triazol-5(4H)-one.

Zhu Yu-Jin YJ Duan Hong-Quan HQ

Acta crystallographica. Section E, Structure reports online 20090123 Pt 2

In the title compound, C(16)H(15)N(3)O, the triazole ring makes dihedral angles of 7.08 (2) and 74.53 (3)° with the two outer aromatic rings. The crystal packing is stabilized by very short inter-molecular C-H⋯O hydrogen bonds and weak π-π stacking inter-actions [centroid-to-centroid distance 3.632 (3) Å], resulting in the formation of zigzag chains parallel to the b axis. ...[more]

PMID: 21581980

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