Zn(adipate)(4,4'-bipyridine) | 849192-62-7

• 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(adipate)(4,4'-bipyridine)
• CAS: 849192-62-7
• 化学式: C₆H₈O₄*C₁₀H₈N₂*Zn
• 分子量: 365.704
• InChiKey: WQSYSAMWYHYVEM-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  0.19
• 重原子数：
  23.0
• 可旋转键数：
  6.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  106.04
• 氢给体数：
  0.0
• 氢受体数：
  6.0

反应信息

• 作为产物：
  描述：

  4,4'-联吡啶 、 zinc(II) sulfate heptahydrate 、 己二酸 、 sodium carbonate 以 甲醇 、 水 为溶剂， 以5%的产率得到Zn(adipate)(4,4'-bipyridine)
  参考文献：
  名称：

  New α,ω-dicarboxylate coordination polymers with 4,4′-bipyridine: Cu(bpy)(C5H6O4), Zn(bpy)(C5H6O4), Zn(bpy)(C6H8O4) and Mn(bpy)(C8H12O4)·H2O

  摘要：

  Four 4,4'-bipyridine alpha,omega-dicarboxylate coordination polymers Cu(bpy)(C5H6O4) (1), Zn(bpy)(C5H6O4) (2), Zn(bpy)(C6H8O4) (3) and Mn(bpy)(C8H12O4) (.) H2O (4) have been synthesized and structurally characterized by single crystal X-ray diffraction methods (bpy = 4,4-bipyridine, (C5H6O4)(2-) = glutarate anion, (C6H8O4)(2-) = adipate anion, (C8H12O4)(2-) = suberate anion). Their crystal structures are featured by dimeric metal units, which are co-bridged by 4,4'-bipyridine ligands and dicarboxylate anions such as glutarate, adipate and suberate anions to generate 2D layers with a (4,4) topology in 1, 2 and 4 as well as to form 3D frameworks in 3. Two 3D frameworks in 3 interpenetrate with each other to form a topology identical to the well-known Nb6F15 cluster compound. Over 5-300 K, the paramagnetic behavior of 4 follows the Curie-Weiss law X-m (T - Theta) = 4.265(5) cm(3) mol(-1) with the Weiss constant Theta = -6.3(2) K. Furthermore, the thermal behavior of 3 and 4 is also discussed. (C) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2004.11.025