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出 处:《Chinese Journal of Structural Chemistry》2018年第7期1125-1132,共8页结构化学(英文)
基 金:supported by the National Natural Science Foundation of China(21503183,21663031);the Provincial Level Innovation Programs Fund of undergraduate for 2017(No.D2017010)
摘 要:One coordination polymer(CP) {[Mn(ADA)(Phen)](H2O)2}n(1, H2ADA = azobenzene-4,4'-dicarboxylic acid, Phen = 1,10-phenanthroline), has been synthesized via hydrothermal reactions. CP 1 was characterized by elemental analyses, IR spectra, thermal behaviors, and X-ray single-crystal diffraction. In CP 1, each ADA(2-) ligand bridges two Mn(2+) to give one-dimensional zigzag chains with the Mn···Mn separations of 17.6911 and 16.3976 A, which generates a three-dimensional supramolecular structure by means of strong π···π interaction and hydrogen bonding. It crystallizes in triclinic, space group P1, with a = 7.6200(13), b = 9.1530(15), c = 18.262(2) A, α = 88.467(3)o, β = 84.145(2)o, γ = 77.542(2)o, V = 1237.2(3) A3, Z = 2, C(26)H(20)MnN4O6, Mr = 539.40, Dc = 1.448 g/cm3, F(000) = 554, S = 1.018, R = 0.0531 and w R = 0.1094. In addition, natural bond orbital analysis was performed by the B3 LYP/LANL2 DZ method of Gaussian 09 Program. The fluorescence, magnetic, and electrochemical properties of 1 have been investigated.One coordination polymer(CP) {[Mn(ADA)(Phen)](H2O)2}n(1, H2ADA = azobenzene-4,4'-dicarboxylic acid, Phen = 1,10-phenanthroline), has been synthesized via hydrothermal reactions. CP 1 was characterized by elemental analyses, IR spectra, thermal behaviors, and X-ray single-crystal diffraction. In CP 1, each ADA(2-) ligand bridges two Mn(2+) to give one-dimensional zigzag chains with the Mn···Mn separations of 17.6911 and 16.3976 A, which generates a three-dimensional supramolecular structure by means of strong π···π interaction and hydrogen bonding. It crystallizes in triclinic, space group P1, with a = 7.6200(13), b = 9.1530(15), c = 18.262(2) A, α = 88.467(3)o, β = 84.145(2)o, γ = 77.542(2)o, V = 1237.2(3) A3, Z = 2, C(26)H(20)MnN4O6, Mr = 539.40, Dc = 1.448 g/cm3, F(000) = 554, S = 1.018, R = 0.0531 and w R = 0.1094. In addition, natural bond orbital analysis was performed by the B3 LYP/LANL2 DZ method of Gaussian 09 Program. The fluorescence, magnetic, and electrochemical properties of 1 have been investigated.
关 键 词:SYNTHESIS STRUCTURE fluorescence magnetic electrochemical properties
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