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1-Benzyl-5-methyl-1H-1,2,3-triazole-4-carboxylic acid monohydrate.

ABSTRACT: In the title compound, C(11)H(11)N(3)O(2)·H(2)O, the planes of the triazole and phenyl rings are almost perpendicular to each other [dihedral angle 89.5?(3)°]. The crystal packing is stabilized by strong inter-molecular O-H?O and O-H?N hydrogen bonds involving the water mol-ecule as both donor and acceptor.

SUBMITTER: Zhao H

PROVIDER: S-EPMC2969608 | biostudies-literature | 2009 May

REPOSITORIES: biostudies-literature

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1-Benzyl-5-methyl-1H-1,2,3-triazole-4-carboxylic acid monohydrate.

Zhao Hong H

Acta crystallographica. Section E, Structure reports online 20090514 Pt 6

In the title compound, C(11)H(11)N(3)O(2)·H(2)O, the planes of the triazole and phenyl rings are almost perpendicular to each other [dihedral angle 89.5 (3)°]. The crystal packing is stabilized by strong inter-molecular O-H⋯O and O-H⋯N hydrogen bonds involving the water mol-ecule as both donor and acceptor. ...[more]

PMID: 21583123

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