Publication details

Bis(2-amino-4-methylpyrimidin-3-ium) trans-diaquabis(pyrazine-2,3-dicarboxylato)cobaltate(II) hexahydrate

Authors

ESHTIAGH-HOSSEINI Hossein NEČAS Marek ALFI Nafiseh MIRZAEI Masoud

Year of publication 2010
Type Article in Periodical
Magazine / Source Acta Crystallographica Section E: Structure Reports Online
MU Faculty or unit

Faculty of Science

Citation
Web https://doi.org/10.1107/S1600536810037736
Doi http://dx.doi.org/10.1107/S1600536810037736
Keywords single-crystal X-ray study; T = 120 K; mean (C–C) = 0.002 angstrom; R factor = 0.025; wR factor = 0.064; data-to-parameter ratio = 10.8.
Description In the crystal structure of the mononuclear title compound, (C(5)H(8)N(3))(2)[Co(C(6)H(2)N(2)O(4))(2)(H(2)O)(2)]center dot 6H(2)O or (ampymH)(2)[Co( pyzdc)(2)(H(2)O)(2)]center dot 6H(2)O (ampym = 2-amino-4-methyl pyrimidine, pyzdcH(2) = pyrazine-2,3-dicarboxylic acid), the Co(II) ion is hexacoordinated by two (pyzdc)(2-) groups in the equatorial plane and two water molecules in axial positions, giving an N(2)CoO(4) bound set. The (pyzdc)(2-) anion acts as a bidentate ligand through one carboxylate group O atom and pyrazine ring N atom. There are diverse N-H center dot center dot center dot O and O-H center dot center dot center dot O and O-H center dot center dot center dot N hydrogen-bonding interactions, which lead to the formation of a three-dimensional supramolecular architecture. Off-set or slipped pi-pi stacking interactions are also observed between adjacent pyrimidine rings with face-to-face distances of 3.6337 (9) angstrom.

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