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2,6-Di­amino-4-chloro­pyrimidinium 4-carb­oxy­butano­ate

In the title mol­ecular salt, C(4)H(6)ClN(4) (+)·C(5)H(7)O(4) (−), the cation is essentially planar, with a maximum deviation of 0.037 (1) Å for all non-H atoms. The anions are self-assembled through O—H⋯O hydrogen bonds, forming a supra­molecular zigzag chain with graph-set notation C(8). In the cr...

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Detalles Bibliográficos
Autores principales: Edison, Bellarmin, Balasubramani, Kasthuri, Thanigaimani, Kaliyaperumal, Khalib, Nuridayanti Che, Arshad, Suhana, Razak, Ibrahim Abdul
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4158549/
https://www.ncbi.nlm.nih.gov/pubmed/25249908
http://dx.doi.org/10.1107/S1600536814015220
Descripción
Sumario:In the title mol­ecular salt, C(4)H(6)ClN(4) (+)·C(5)H(7)O(4) (−), the cation is essentially planar, with a maximum deviation of 0.037 (1) Å for all non-H atoms. The anions are self-assembled through O—H⋯O hydrogen bonds, forming a supra­molecular zigzag chain with graph-set notation C(8). In the crystal, the protonated N atom and the 2-amino group of the cation are hydrogen bonded to the carboxyl­ate O atoms of the anion via a pair of N—H⋯O hydrogen bonds with an R (2) (2)(8) ring motif. This motif further self-organizes through N—H⋯O and O—H⋯O hydrogen bonds, generating an array of six hydrogen bonds, the rings having graph-set notation R (3) (2)(8), R (2) (2)(8), R (4) (2)(8), R (2) (2)(8) and R (3) (2)(8). In addition, another type of R (2) (2)(8) motif is formed by inversion-related pyrimidinium cations via N—H⋯N hydrogen bonds, forming a two-dimensional network parallel to (101).