Abstract:Key indicators: single-crystal X-ray study; T = 293 K; mean (C-C) = 0.002 Å; R factor = 0.031; wR factor = 0.081; data-to-parameter ratio = 10.5.The title molecule, C 6 H 7 N 3 O, is almost planar (r.m.s. deviation = 0.0068 Å ) and adopts an E conformation about the C N double bond. In the crystal, molecules are linked by pairs of strong N-HÁ Á ÁN hydrogen bonds, forming inversion dimers with R 2 2 (10) motifs. The dimers are further linked into C(3) chains through O-HÁ Á ÁN hydrogen bonds.
Related literature
Set email alert for when this publication receives citations?
scite is a Brooklyn-based organization that helps researchers better discover and understand research articles through Smart Citations–citations that display the context of the citation and describe whether the article provides supporting or contrasting evidence. scite is used by students and researchers from around the world and is funded in part by the National Science Foundation and the National Institute on Drug Abuse of the National Institutes of Health.