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2-Amino-4-methyl-6-oxo-3,6-dihydro­pyrimidin-1-ium perchlorate–2-amino-6-methyl­pyrimidin-4(1H)-one–water (1/1/1)

In the title compound, C(5)H(8)N(3)O(+)·ClO(4) (−)·C(5)H(7)N(3)O·H(2)O, each perchlorate anion is paired with a protonated cationic 2-amino-6-methyl­pyrimidin-4(1H)-one and another non-protonated entity of the same organic pyrimidinone. The crystal structure is stabilized by N—H⋯O(org), N—H⋯O(water)...

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Detalles Bibliográficos
Autores principales: Kaabi, Kamel, El Glaoui, Maher, Ferretti, Valeria, Zeller, Matthias, Ben Nasr, Cherif
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3200758/
https://www.ncbi.nlm.nih.gov/pubmed/22065517
http://dx.doi.org/10.1107/S1600536811034106
Descripción
Sumario:In the title compound, C(5)H(8)N(3)O(+)·ClO(4) (−)·C(5)H(7)N(3)O·H(2)O, each perchlorate anion is paired with a protonated cationic 2-amino-6-methyl­pyrimidin-4(1H)-one and another non-protonated entity of the same organic pyrimidinone. The crystal structure is stabilized by N—H⋯O(org), N—H⋯O(water), N—H⋯O(ClO4), O—H⋯O(ClO4), N—H⋯N and C—H⋯O(ClO4) hydrogen bonds between the anions, organic entities and water mol­ecules. Inter­molecular π–π stacking inter­actions between neighbouring organic rings are observed with a face-to-face distance of 3.776 (2) Å, and O—H⋯O hydrogen bonds link the perchlorate anions and the water mol­ecules into chains along the b-axis direction. The perchlorate anion and the inter­stitial water mol­ecule are disordered over two mutually incompatible positions with a common occupancy ratio of 0.678 (16):0.322 (16).