The title compound, [Cu（C6H4N2O4F）2（H2O）4].4（H2O） I, has been hydrothermally synthesized and structurally determined by single-crystal X-ray diffraction method. It crystallizes in monoclinic, space group P21/c w...The title compound, [Cu（C6H4N2O4F）2（H2O）4].4（H2O） I, has been hydrothermally synthesized and structurally determined by single-crystal X-ray diffraction method. It crystallizes in monoclinic, space group P21/c with a = 8.3041（17）, b = 12.045（2）, c = 11.077（2） A, β = 92.567（3）°, V= 1106.8（4） A^3, Mr = 581.89, Z= 2, Dc = 1.746 g/cm^3, F（000） = 598,μ（MoKa） = 1.090 mm^-1, the final R = 0.0296 and wR = 0.0806 for 3195 observed reflections with Ⅰ 〉 2σ（Ⅰ）. In the centrosymmetric compound I, each Cu（Ⅱ） ion is coordinated by six O atoms from two 5-fluorouracil-1-acetate anions and four water molecules, forming a six-coordinated octahedral environment. N-H…O and O-H…O hydrogen-bonding interactions are observed in the structure, leading to the formation of a three-dimensional network.展开更多
基金This work was supported by the National Natural Science Foundation of China (No. 20571057)
文摘The title compound, [Cu（C6H4N2O4F）2（H2O）4].4（H2O） I, has been hydrothermally synthesized and structurally determined by single-crystal X-ray diffraction method. It crystallizes in monoclinic, space group P21/c with a = 8.3041（17）, b = 12.045（2）, c = 11.077（2） A, β = 92.567（3）°, V= 1106.8（4） A^3, Mr = 581.89, Z= 2, Dc = 1.746 g/cm^3, F（000） = 598,μ（MoKa） = 1.090 mm^-1, the final R = 0.0296 and wR = 0.0806 for 3195 observed reflections with Ⅰ 〉 2σ（Ⅰ）. In the centrosymmetric compound I, each Cu（Ⅱ） ion is coordinated by six O atoms from two 5-fluorouracil-1-acetate anions and four water molecules, forming a six-coordinated octahedral environment. N-H…O and O-H…O hydrogen-bonding interactions are observed in the structure, leading to the formation of a three-dimensional network.
