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Citation: QIAN Bao-Hua, MA Wei-Xing, XU Xing-You, LU Lu-De, YANG Xu-Jie, WANG Xin. Synthesis, Characterization and Quantum Chemistry Study of a One-dimensional Chain Coordination Polymer [Zn(acac)₂(4,4’-bipy)]_n[J]. Acta Physico-Chimica Sinica, ;2008, 24(09): 1650-1654. doi: 10.3866/PKU.WHXB20080921 shu

Synthesis, Characterization and Quantum Chemistry Study of a One-dimensional Chain Coordination Polymer [Zn(acac)₂(4,4’-bipy)]_n

1.
Materials Chemistry Laboratory, Nanjing University of Science &Technology, Nanjing 210094, P. R. China; Department of Chemical Technology, Huaihai Institute of Technology, Lianyungang 222005, Jiangsu Province, P. R. China

Received Date: 30 January 2008
Available Online: 17 July 2008

A novel one-dimensional zinc(II) coordination polymer [Zn(acac)2(4,4’-bipy)]n was solvothermally synthesized and characterized by IR, elemental analysis, thermal analysis, 1H NMR, and X-ray diffraction methods. The complex crystallized in monoclinic system, space group P2(1)/c with a=1.1366(10) nm, b=1.4914(14) nm, c=1.5534(10) nm, β=132.00(4)°, V=1.957(3) nm3, Z=4. It was confirmed that the Zn(acac)2 and 4,4’-bipy formed a one-dimension linear structure with molecular ratio of 1:1. The result of TG analysis showed that the title complex was stable under 197 ℃. The distribution of charges and the composition of frontier molecular orbits provided a od testimony for the coordination condition in the crystal structure.
- Zinc (II) coordination polymer; Solvothermal synthesis; Crystal structure; Quantum chemistry calculation
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Synthesis, Characterization and Quantum Chemistry Study of a One-dimensional Chain Coordination Polymer [Zn(acac)2(4,4’-bipy)]n

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通讯作者: 陈斌, bchen63@163.com

Synthesis, Characterization and Quantum Chemistry Study of a One-dimensional Chain Coordination Polymer [Zn(acac)₂(4,4’-bipy)]_n