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1-(4-Nitro-phenoxy-meth-yl)-1H-1,2,4-triazole.

ABSTRACT: The asymmetric unit of the title compound, C(9)H(8)N(4)O(3), contains two independent mol-ecules. The dihedral angles formed by the triazole and benzene rings in the two independent mol-ecules are 83.3 (3) and 86.9 (4)°. The mol-ecular packing involves weak C-H⋯N and C-H⋯O inter-actions, and π-π stacking inter-actions [centroid-to-centroid distance 3.745 (1) Å] between the aromatic rings of pairs of mol-ecules.

SUBMITTER: Li J

PROVIDER: S-EPMC2914979 | biostudies-literature | 2007 Dec

REPOSITORIES: biostudies-literature

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1-(4-Nitro-phenoxy-meth-yl)-1H-1,2,4-triazole.

Li Jian J

Acta crystallographica. Section E, Structure reports online 20071206 Pt 1

The asymmetric unit of the title compound, C(9)H(8)N(4)O(3), contains two independent mol-ecules. The dihedral angles formed by the triazole and benzene rings in the two independent mol-ecules are 83.3 (3) and 86.9 (4)°. The mol-ecular packing involves weak C-H⋯N and C-H⋯O inter-actions, and π-π stacking inter-actions [centroid-to-centroid distance 3.745 (1) Å] between the aromatic rings of pairs of mol-ecules. ...[more]

PMID: 21200735

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