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1H-Benzotriazole-4-hy-droxy-benzoic acid (1/1).

ABSTRACT: The asymmetric unit of the title compound, C6H5N3·C7H6O3, comprises independent benzotriazole and 4-hydroxybenzoic acid molecules. The dihedral angle between the benzene ring and the benzotriazole ring system is 15.18?(7)°. The mean plane of the carb-oxyl group is twisted at an angle of 18.55?(1)° with respect to the benzene ring. The crystal structure is stabilized by weak inter-molecular N-H?N, O-H?N, O-H?O and C-H?O inter-actions, forming a three-dimensional network.

SUBMITTER: Thirunavukkarasu A

PROVIDER: S-EPMC3884281 | biostudies-literature | 2013 Oct

REPOSITORIES: biostudies-literature

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1H-Benzotriazole-4-hy-droxy-benzoic acid (1/1).

Thirunavukkarasu A A Silambarasan A A Chakkaravarthi G G Mohankumar R R Umarani P R PR

Acta crystallographica. Section E, Structure reports online 20131002 Pt 11

The asymmetric unit of the title compound, C6H5N3·C7H6O3, comprises independent benzotriazole and 4-hydroxybenzoic acid molecules. The dihedral angle between the benzene ring and the benzotriazole ring system is 15.18 (7)°. The mean plane of the carb-oxyl group is twisted at an angle of 18.55 (1)° with respect to the benzene ring. The crystal structure is stabilized by weak inter-molecular N-H⋯N, O-H⋯N, O-H⋯O and C-H⋯O inter-actions, forming a three-dimensional network. ...[more]

PMID: 24454057

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