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Crystal structure and Hirshfeld surface analysis of 7-eth­oxy-5-methyl-2-(pyridin-3-yl)-11,12-di­hydro-5,11-methano­[1,2,4]triazolo[1,5-c][1,3,5]benzoxadiazo­cine

The title compound, C(19)H(19)N(5)O(2), was prepared by the reaction of 3-amino-5-(pyridin-3-yl)-1,2,4-triazole with acetone and 2-hy­droxy-3-eth­oxy­benzaldehyde. It crystallizes from ethanol in a tetra­gonal space group, with one mol­ecule in the asymmetric unit. The 1,2,4-triazole five-membered r...

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Detalles Bibliográficos
Autores principales: Aydemir, Ercan, Kansiz, Sevgi, Gumus, Mustafa Kemal, Gorobets, Nikolay Yu., Dege, Necmi
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2018
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5947805/
https://www.ncbi.nlm.nih.gov/pubmed/29765725
http://dx.doi.org/10.1107/S2056989018002621
Descripción
Sumario:The title compound, C(19)H(19)N(5)O(2), was prepared by the reaction of 3-amino-5-(pyridin-3-yl)-1,2,4-triazole with acetone and 2-hy­droxy-3-eth­oxy­benzaldehyde. It crystallizes from ethanol in a tetra­gonal space group, with one mol­ecule in the asymmetric unit. The 1,2,4-triazole five-membered ring is planar (maximum deviation = 0.0028 Å). The pyridine and phenyl rings are also planar with maximum deviations of 0.0091 and 0.0094 Å, respectively. In the crystal, N—H⋯N hydrogen bonds link the mol­ecules into supra­molecular chains propagating along the c-axis direction. Hirshfeld surface analysis and two-dimensional fingerprint plots have been used to analyse the inter­molecular inter­actions present in the crystal.