4-(1,2,4-Triazol-1-yl)aniline

Fun, Hoong-Kun and Quah, Ching Kheng and Chandrakantha , B and Isloor, Arun M and Shetty, Prakash (2011) 4-(1,2,4-Triazol-1-yl)aniline. Acta Crystallographica Section E, 67 (1). p. 164. ISSN 1600-5368

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Official URL: http://journals.iucr.org/e/issues/2011/01/00/hb576...

Abstract

In the title compound, C8H8N4, the dihedral angle between the triazole ring [maximum deviation = 0.003 (1) A ° ] and the benzene ring is 34.57 (7)'. In the crystal, molecules are linked into sheets lying parallel to the ac plane via intermolecular N—H...N and C—H...N hydrogen bonds. Aromatic [centroid–centroid distance = 3.6750 (8) A ° ] stacking and N—H... interactions are also observed.

Item Type: Article
Additional Information: © International Union of Crystallography
Uncontrolled Keywords: single-crystal X-ray study; T = 296 K; mean (C–C) = 0.002 A° ;R factor = 0.044; wR factor = 0.118; data-to-parameter ratio = 19.6.
Subjects: Engineering > MIT Manipal > Chemistry
Engineering > MIT Manipal > Printing and Media
Depositing User: MIT Library
Date Deposited: 10 Jan 2012 10:38
Last Modified: 10 Jan 2012 10:38
URI: http://eprints.manipal.edu/id/eprint/2051

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