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https://doi.org/10.1107/S1600536808030481
Title: | 7-Dimethyl-amino-2-phenyl-1,2,4-triazolo[1,5-a][1,3,5]triazin-5-amine methanol solvate | Authors: | Dolzhenko, A.V. Tan, G.K. Koh, L.L. Woo, S.F. Chui, W.K. |
Issue Date: | 2008 | Citation: | Dolzhenko, A.V., Tan, G.K., Koh, L.L., Woo, S.F., Chui, W.K. (2008). 7-Dimethyl-amino-2-phenyl-1,2,4-triazolo[1,5-a][1,3,5]triazin-5-amine methanol solvate. Acta Crystallographica Section E: Structure Reports Online 64 (10) : o2021-. ScholarBank@NUS Repository. https://doi.org/10.1107/S1600536808030481 | Abstract: | 7-Dimethyl-amino-2-phenyl-1,2,4-triazolo[1,5-a][1,3,5]triazin-5-amine crystallized with one mol-ecule of methanol to give the title compound, C 12H13N7·CH3OH. The triazolo[1,5-a][1,3,5]triazine heterocyclic core is essentially planar as are both amino groups that are involved in π-electron delocalization with the triazolo[1,5-a][1,3,5]triazine nucleus. The methyl groups of the dimethyl-amino fragment are involved in the formation of weak intra-molecular C - H...N hydrogen bonds with the N atoms of the heterocyclic system. The crystal packing is stabilized by inter-molecular N - H...N hydrogen bonds between the triazolo[1,5-a][1,3,5]triazine mol-ecules. The methanol solvent mol-ecule also participates in the formation of the crystal structure via inter-molecular O - H...N, N - H...O and weak C - H...O hydrogen bonds, linking the layers of triazolo[1,5-a][1,3,5]triazine mol-ecules. | Source Title: | Acta Crystallographica Section E: Structure Reports Online | URI: | http://scholarbank.nus.edu.sg/handle/10635/92919 | ISSN: | 16005368 | DOI: | 10.1107/S1600536808030481 |
Appears in Collections: | Staff Publications |
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