The title compound, C(12)H(14)N(5)O(2) (+)·Cl(-)·H(2)O, is the monohydrate of the hydro-chloride of an oxopurine-derived Schiff base in which protonation took place at the pyridine N atom. The organic cation is essentially planar (r.m.s. of all fitted non-H atoms = 0.0373â à ). In the crystal, N-Hâ¯O and N-Hâ¯Cl hydrogen bonds as well as C-Hâ¯O and C-Hâ¯Cl contacts connect the different entities into a three-dimensional network. The shortest centroid-centroid distance between two pyrimidine rings is 3.6364â (9)â à .
2-[(E)-(6-Amino-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetra-hydro-pyrimidin-5-yl)imino-meth-yl]pyridinium chloride monohydrate.
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作者:Booysen Irvin, Ismail Muhammed, Gerber Thomas, Hosten Eric, Betz Richard
| 期刊: | Acta Crystallographica Section E-Structure Reports Online | 影响因子: | 0.600 |
| 时间: | 2011 | 起止号: | 2011 Sep 1; 67(Pt 9):o2436-7 |
| doi: | 10.1107/S1600536811033307 | ||
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