[Zn(II)(4,4'-bipyridine)(oxalato)] | 226401-80-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: [Zn(II)(4,4'-bipyridine)(oxalato)]
• 英文别名: (2).infin.[Zn(oxalate)(4,4'-bipyridine)]；zinc;oxalate;4-pyridin-4-ylpyridine
• CAS: 226401-80-5
• 化学式: C₂O₄*C₁₀H₈N₂*Zn
• 分子量: 309.597
• InChiKey: RZSQROUJWTXTNV-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  -1.37
• 重原子数：
  19.0
• 可旋转键数：
  1.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  106.04
• 氢给体数：
  0.0
• 氢受体数：
  6.0

反应信息

• 作为反应物：
  描述：

  [Zn(II)(4,4'-bipyridine)(oxalato)] 以 solid 为溶剂， 生成 zinc(II) oxide
  参考文献：
  名称：

  摘要：

  The new mixed ligand complexes with the formulae Zn(2-bipy)(ox), Zn(4-bipy)(1.5)(ox)H2O, Zn(2,4'-bipy)(2)(ox)2H(2)O, Cd(2-bipy)(ox)2H(2)O, Cd(4-bipy)(2)(ox) and Cd(2,4'-bipy)(ox)2H(2)O (2-bipy, 4-bipy, 2,4'-bipy=2,2'-, 4,4'- and 2,4'bipyridine, ox=oxalate) were prepared. The thermal decompositions of these compounds were studied by means of TG, DTG and DTA in air. During heating the complexes decompose via different intermediate products to ZnO and CdO. The Zn(II) complexes are thermally more stable than the corresponding Cd(II) complexes. The influence of nitrogen atom position in the bipyridine isomers and nature of central atom on the thermal behaviour of these complexes was discussed.

  DOI：

  10.1023/a:1010145223514
• 作为产物：
  描述：

  [Zn(II)(4,4'-bipyridine)1.5(oxalato)]*H2O 以 solid 为溶剂， 生成 [Zn(II)(4,4'-bipyridine)(oxalato)]
  参考文献：
  名称：

  摘要：

  The new mixed ligand complexes with the formulae Zn(2-bipy)(ox), Zn(4-bipy)(1.5)(ox)H2O, Zn(2,4'-bipy)(2)(ox)2H(2)O, Cd(2-bipy)(ox)2H(2)O, Cd(4-bipy)(2)(ox) and Cd(2,4'-bipy)(ox)2H(2)O (2-bipy, 4-bipy, 2,4'-bipy=2,2'-, 4,4'- and 2,4'bipyridine, ox=oxalate) were prepared. The thermal decompositions of these compounds were studied by means of TG, DTG and DTA in air. During heating the complexes decompose via different intermediate products to ZnO and CdO. The Zn(II) complexes are thermally more stable than the corresponding Cd(II) complexes. The influence of nitrogen atom position in the bipyridine isomers and nature of central atom on the thermal behaviour of these complexes was discussed.

  DOI：

  10.1023/a:1010145223514

文献信息

• Lu, Jack Y., Inorganic Chemistry, 1999, vol. 38, # 11, p. 2695 - 2704
  作者：Lu, Jack Y.

  DOI：——

  日期：——
• Hydrothermal synthesis and crystal structure of a layered coordination polymer: [Zn3(C2O4)3(4,4′-bipy)4]n (4,4′-bipy=4,4′-bipyridine)
  作者：Na Hao、Enhong Shen、Yangguang Li、Enbo Wang、Changwen Hu、Lin Xu

  DOI：10.1016/j.molstruc.2004.01.004

  日期：2004.3

  An interesting metal-organic coordination polymer [Zn-3(C2O4)(3)(4,4'-bipy)(4)]}(n) 1 has been hydrothermally synthesized and characterized by elemental analyses, IR spectrum, TG analysis, and single-crystal X-ray diffraction. Compound I crystallizes in the monoclinic system, space group P2(1)/c, a = 16.264(3) Angstrom, b = 15.603(3) Angstrom, c = 16.343(3) Angstrom, beta = 94.13(3)degrees, V = 4136.5(14) Angstrom(3), Z = 4, R1 = 0.0554, wR(2) = 0.1217. Compound 1 exhibits a 2D network, which consists of infinite zinc (II) oxalate chains connected to each other by a half of 4,4'-bipy acting as bridging ligands, while the other half of 4,4-bipy just does as terminal ones. (C) 2004 Elsevier B.V. All rights reserved.