Abstract
In the title compound, C8H8N4, the dihedral angle between the triazole ring [maximum deviation = 0.003 (1) Å] 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 π–π [centroid–centroid distance = 3.6750 (8) Å] stacking and N—H⋯π interactions are also observed.
Highlights
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)
Molecules are linked into sheets lying parallel to the ac plane via intermolecular N—HÁ Á ÁN and C—HÁ Á ÁN hydrogen bonds
Cg2 is the centroid of the C3–C8 phenyl ring
Summary
Key indicators: 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. C8H8N4, the dihedral angle between the triazole ring [maximum deviation = 0.003 (1) A ] and the benzene ring is 34.57 (7). Molecules are linked into sheets lying parallel to the ac plane via intermolecular N—HÁ Á ÁN and C—HÁ Á ÁN hydrogen bonds. Related literature For general background to and the biological activity of triazole derivatives, see: Isloor et al (2000, 2009); Soliman et al (2001); Holla et al (2000); Sunil et al (2009). For bond-length data, see: Allen et al (1987). See: Fun et al (2010)
Talk to us
Join us for a 30 min session where you can share your feedback and ask us any queries you have
More From: Acta Crystallographica Section E Structure Reports Online
Disclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.