The title compound, C(13)H(12)ClN(7), crystallizes with two independent mol-ecules in the asymmetric unit, each with similar geometries. The dihedral angles between the triazole and pyrimidine rings are 0.45 (9) and 1.00 (10)° in the two mol-ecules. A number of N-H⋯N hydrogen bonds co-operate with C-H⋯N contacts, forming a supra-molecular array in the ab plane. C-H⋯π inter-actions are also present. One of the vinyl groups was found to be disordered so that the C(H)=CH(2) atoms were resolved over two positions with the major component having a site occupancy factor of 0.539 (4).
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http://dx.doi.org/10.1107/S1600536809048168 | DOI Listing |
Acta Crystallogr Sect E Struct Rep Online
December 2011
The title compound, C(17)H(14)ClN(7), crystallizes with two independent mol-ecules in the asymmetric unit. Inter-molecular N-H⋯N and C-H⋯N hydrogen bonds contribute to the stability of the crystal structure. In addition, weak C-H⋯π and π-π stacking [centroid-centroid distances of 3.
View Article and Find Full Text PDFActa Crystallogr Sect E Struct Rep Online
November 2009
The title compound, C(13)H(12)ClN(7), crystallizes with two independent mol-ecules in the asymmetric unit, each with similar geometries. The dihedral angles between the triazole and pyrimidine rings are 0.45 (9) and 1.
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