Title of article :
A purple odyssey: synthesis and structure of 3-amino-4-hydroxy-6-oxocyclohexa-2,4-dien-1-iminium chloride monohydrate
Author/Authors :
Plater, M. John Department of Chemistry - University of Aberdeen, Scotland , Harrison, William T. A. Department of Chemistry - University of Aberdeen, Scotland
Abstract :
In the cation of the title hydrated molecular salt, C6H7N2O2+·Cl−·H2O, the six-membered ring shows unequal bond lengths consistent with delocalization of electrons over two separate 6π systems with single bonds between them. In the crystal, the components are linked by N—H⋯Cl, N—H⋯O, O—H⋯Cl and O—H⋯O hydrogen bonds, generating double layers propagating in (100).
Keywords :
conjugation , crystal structure , layered structure , hydrogen bonds , anti-aromatic
Journal title :
Acta Crystallographica Section E: Crystallographic Communications