Crystal structure of 3-(adamantan-1-yl)-4-(4-chlorophenyl)-1H-1,2,4-triazole-5(4H)-thione

2Citations
Citations of this article
5Readers
Mendeley users who have this article in their library.

Abstract

The title compound, C18H20ClN3S, is a functionalized triazo-line-3-thione derivative. The benzene ring is almost perpendicular to the planar 1, 2, 4-triazole ring [maximum deviation = 0.007 (1) Å] with a dihedral angle of 89.61 (5)° between them and there is an adamantane substituent at the 3-position of the triazolethione ring. In the crystal, N - H⋯S hydrogen-bonding interactions link the molecules into chains extending along the c-axis direction. The crystal packing is further stabilized by weak C - H⋯n interactions that link adjacent chains into a two-dimensional structure in the bc plane. The crystal studied was an inversion twin with a 0.50 (3):0.50 (3) domain ratio.

Cite

CITATION STYLE

APA

Al-Wabli, R. I., El-Emam, A. A., Alroqi, O. S., Chidan Kumar, C. S., Fun, H. K., & Simpson, J. (2015). Crystal structure of 3-(adamantan-1-yl)-4-(4-chlorophenyl)-1H-1,2,4-triazole-5(4H)-thione. Acta Crystallographica Section E: Structure Reports Online, 71(2), o115–o116. https://doi.org/10.1107/S2056989015000596

Register to see more suggestions

Mendeley helps you to discover research relevant for your work.

Already have an account?

Save time finding and organizing research with Mendeley

Sign up for free