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The crystal structure of [Ni(C5H2N2O4)(2, 2?bipy)(H2O)2]?H2O 1 has been determined by X-ray diffraction. Crystal data: triclinic system, space group P with a = 7.9424(3), b = 9.9417(3), c = 12.1867(3) ? a = 84.771(1), b = 77.375(2), g = 68.993(2)? C15H18N4O8Ni, Mr = 440.7, V = 876.16(5) 3, Z = 2, Dc = 1.672 g/cm3, F(000) = 456, m(MoKa) = 1.162 mm-1, the final R = 0.0464 and wR = 0.1055 for 3026 observed reflections with I > 2s(I). In the title compound, the nickel ion is coordinated by a nitrogen atom and an oxygen atom from the orotate ligand, two nitrogen atoms from 2, 2?bipy and two oxygen atoms from the coordinated water molecules in a distorted octahedral geometry. The presence of intermolecular hydrogen bonding and p-p stacking interaction of aromatic rings from 2, 2?bipy results in a 3D structure.
The crystal structure of [Ni (C5H2N2O4) (2,2? Bipy) (H2O) 2]? H2O has been determined by X-ray diffraction. Crystal data: triclinic system, space group P with a = 7.9424 b = 9.9417 (3), c = 12.1867 (3)? a = 84.771 (1), b = 77.375 (2), g = 68.993 (2)? C15H18N4O8Ni, Mr = 440.7, V = 876.16 = 2, Dc = 1.672 g / cm3, F (000) = 456, m (MoKa) = 1.162 mm-1, the final R = 0.0464 and wR = 0.1055 for 3026 observed at reflections with I> 2s (I) title compound, the nickel ion is coordinated by a nitrogen atom and an oxygen atom from the orotate ligand, two nitrogen atoms from 2, 2? bipy and two oxygen atoms from the coordinated water molecules in a distorted octahedral geometry. The presence of intermolecular hydrogen bonding and pp stacking interaction of aromatic rings from 2, 2? bipy results in a 3D structure.