3-(Adamantan-1-yl)-4-benzyl-1H-1,2,4-triazole-5(4H)-thione

The title compound, C(19)H(23)N(3)S, is a functionalized triazoline-3-thione derivative. The benzyl ring is almost normal to the planar 1,2,4-triazole ring (r.m.s. deviation = 0.007 Å) with a dihedral angle of 86.90 (7)°. In the crystal, molecules are linked by pairs of N—H⋯S hydrogen bonds, forming...

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Detalles Bibliográficos
Autores principales: Al-Omary, Fatmah A. M., Ghabbour, Hazem A., El-Emam, Ali A., Chidan Kumar, C. S., Fun, Hoong-Kun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4120616/
https://www.ncbi.nlm.nih.gov/pubmed/25161557
http://dx.doi.org/10.1107/S1600536814013257
Descripción
Sumario:The title compound, C(19)H(23)N(3)S, is a functionalized triazoline-3-thione derivative. The benzyl ring is almost normal to the planar 1,2,4-triazole ring (r.m.s. deviation = 0.007 Å) with a dihedral angle of 86.90 (7)°. In the crystal, molecules are linked by pairs of N—H⋯S hydrogen bonds, forming inversion dimers that enclose R (2) (2)(8) loops. The crystal packing is further stabilized by weak C—H⋯π inter­actions that link adjacent dimeric units into supra­molecular chains extending along the a-axis direction.

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