Author:
Manjula P. S.,Sarojini B. K.,Narayana B.,Byrappa K.,Madan Kumar S.
Abstract
The title compound, C10H9FN4S, crystallizes with two molecules (AandB) in the asymmetric unit. The dihedral angle between the planes of the trizole and fluorobenzene rings is 7.3 (3)° in moleculeAand 41.1 (3)° in moleculeB. MoleculeAfeatures an intramolecular C—H...S hydrogen bond, which closes anS(6) ring. In the crystal,A+Bdimers linked by pairs of N—H...S hydrogen bonds occur, generatingR22(8) loops. Weak π–π stacking contacts [centroid–centroid separation = 3.739 (6) Å] are also observed.
Publisher
International Union of Crystallography (IUCr)
Subject
Condensed Matter Physics,General Materials Science,General Chemistry
Reference7 articles.
1. OLEX2: a complete structure solution, refinement and analysis program
2. Mercury CSD 2.0– new features for the visualization and investigation of crystal structures
3. The crystal structures of three 3-methyl-1H-1,2,4-triazole-5-thiones, including a second polymorph of 4-[(E)-(5-bromo-2-hydroxybenzylidene)amino]-3-methyl-1H-1,2,4-triazole-5(4H)-thione and a redetermination of 4-amino-3-methyl-1H-1,2,4-triazole-5(4H)-thione
4. Rigaku (1999). NUMABS. Rigaku Corporation, Tokyo, Japan.
5. Rigaku (2011). CrystalClear SM Expert. Rigaku Corporation, Tokyo, Japan.
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