5-Carboxy-2-isopropyl-1H-imidazol-3-ium-4-carboxylate monohydrate

In the title compound, C8H10N2O4·H2O, the imidazole N atom is protonated and one of the carboxylate groups is deprotoned, forming a zwitterion. An intramolecular O—H...O hydrogen bond occurs. The crystal structure is stabilized by intermolecular N—H...O and O...

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Bibliographic Details
Main Authors: Chao-Jun Du, Zheng-Hai Shi, Li-Sheng Wang, Chao-Ling Du
Format: Article
Language:English
Published: International Union of Crystallography 2011-07-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536811024767
Description
Summary:In the title compound, C8H10N2O4·H2O, the imidazole N atom is protonated and one of the carboxylate groups is deprotoned, forming a zwitterion. An intramolecular O—H...O hydrogen bond occurs. The crystal structure is stabilized by intermolecular N—H...O and O—H...O hydrogen bonds. In addition, intermolecular N—H...O and O—H...O hydrogen bonds link the molecules into two-dimensional networks parallel to (10overline{2}).
ISSN:1600-5368