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4-Amino-3-(o-tolyloxymethyl)-1H-1,2,4-triazole-5(4H)-thione
The asymmetric unit of the title compound, C(10)H(12)N(4)OS, contains two independent molecules, A and B, which differ significantly in the relative orientations of the benzene and triazole rings. The dihedral angle between the above two rings is 6.94 (5)° in molecule A and 77.60 (5)° in molecule...
Autores principales: | , , , , |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2009
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2977493/ https://www.ncbi.nlm.nih.gov/pubmed/21583598 http://dx.doi.org/10.1107/S1600536809027275 |
Sumario: | The asymmetric unit of the title compound, C(10)H(12)N(4)OS, contains two independent molecules, A and B, which differ significantly in the relative orientations of the benzene and triazole rings. The dihedral angle between the above two rings is 6.94 (5)° in molecule A and 77.60 (5)° in molecule B. In the crystal, molecules are linked into a three-dimensional network by N—H⋯S, N—H⋯O, N—H⋯N and C—H⋯S hydrogen bonds and π–π interactions between the benzene and triazole rings [centroid–centroid distance = 3.5311 (6) Å] are also present. |
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