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4-Amino-3,5-bis(2-pyridyl)-4H-1,2,4-triazole–benzene-1,2,3-tricarboxylic acid–water (1/1/2)
Cocrystallization of 4-amino-3,5-bis(2-pyridyl)-1,2,4-triazole (2-bpt) with hemimellitic acid (benzene-1,2,3-tricarboxylic acid) dihydrate (H(3)HMA·2H(2)O) produces the supramolecular title compound, C(12)H(10)N(6)·C(9)H(6)O(6)·2H(2)O. Intermolecular N—H⋯N hydrogen bonds are observed between the...
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2010
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2979117/ https://www.ncbi.nlm.nih.gov/pubmed/21579130 http://dx.doi.org/10.1107/S1600536810010470 |
Sumario: | Cocrystallization of 4-amino-3,5-bis(2-pyridyl)-1,2,4-triazole (2-bpt) with hemimellitic acid (benzene-1,2,3-tricarboxylic acid) dihydrate (H(3)HMA·2H(2)O) produces the supramolecular title compound, C(12)H(10)N(6)·C(9)H(6)O(6)·2H(2)O. Intermolecular N—H⋯N hydrogen bonds are observed between the terminal pyridyl and amino groups of the 2-bpt molecule and the dihedral angles between the central ring and the pendant pyridine rings are 3.4 (7) and 13.8 (7)°. In the structure, homosynthons of graph set R (2) (2)(8) are observed to form centrosymmetric H(3)HMA dimers, which are extended into a two-dimensional supramolecular layer via intermolecular O—H⋯N and C—H⋯O hydrogen bonds and π–π stacking interactions [centroid–centroid distance = 3.541 (3) Å]. In addition, interlayer uncoordinated water molecules connect the layers through O—H⋯O hydrogen bonds, generating a three-dimensional network. |
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