[Cu(nicotinamide)(valerate)2]2 | 931089-66-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯
• 英文名称: [Cu(nicotinamide)(valerate)2]2
• 英文别名: [Cu(II)(nicotinamide)(μ-valerate)2]2
• CAS: 931089-66-6
• 化学式: C₃₂H₄₈Cu₂N₄O₁₀
• 分子量: 775.846
• InChiKey: WPPJCYYKTFPFKJ-UHFFFAOYSA-J

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为产物：
  描述：

  烟酰胺 、 copper(II) n-valerate 以 乙醇 为溶剂， 生成 [Cu(nicotinamide)(valerate)2]2
  参考文献：
  名称：

  Coordination compounds of 3d-metal valerates and benzoates with nicotinamide

  摘要：

  Complexes of iron(II), cobalt(II), nickel(II), copper(II), and zinc valerates and benzoates with nicotinamide were synthesized. The products were characterized by chemical analysis, IR spectroscopy, diffuse reflection spectroscopy, and thermogravimetry.

  DOI：

  10.1134/s107036320709023x

文献信息

• Synthesis and crystal structure of the copper(II) valerate complex with nicotinamide
  作者：A. S. Antsyshkina、T. V. Koksharova、G. G. Sadikov、I. S. Gritsenko、V. S. Sergienko、O. A. Egorova

  DOI：10.1134/s003602360606009x

  日期：2006.6

  A coordination compound of copper(II) valerate with nicotinamide, [CuL(C4H9COO)(2)](2) (I), has been synthesized, and its crystal structure has been determined by X-ray crystallography. The crystals of I are triclinic: a = 9.1245(9)angstrom, b = 9.8572(6) angstrom, c = 11.0944(9) angstrom, alpha = 73.51(1)degrees, beta = 79.917(6)degrees, gamma = 72.161(7)degrees, Z = 2, space group P1. In the centrosymmetric binuclear molecule of I, the copper atoms (Cu...Cu', 2.621 angstrom) are linked through four bidentate chelating valerate ligands (av., Cu-O 1.969 angstrom). The coordination polyhedron of the Cu atom is a tetragonal pyramid with the nitrogen atom of the pyridine ring in the apical position at a longer distance (Cu-N, 2.190 angstrom).