| 679399-61-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• CAS: 679399-61-2
• 化学式: C₃₀H₄₀Cu₂O₁₄
• 分子量: 751.731
• InChiKey: CSUMGVVVAJVLRU-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：

  甲醇 、 以 甲醇 、 甲苯 为溶剂， 生成
  参考文献：
  名称：

  Dinuclear and mononuclear copper(II) carboxylate complexes with cis-chelating diacids

  摘要：

  The synthesis and crystal structures of two new copper complexes with chelating dicarboxylic acids are described. Reaction of copper(II) acetate with diacid H2L2 (HO2CC(Me)(2)OArOC(Me)(2)CO2H, Ar = 1,3-substituted phenyl) gave a bischelate complex (L-2)(2)Cu-2 (.) 2MeOH with the normal paddlewheel structure and tilted, trans-oriented chelate rings with skewed conformations. The overall structure was reasonably well reproduced by density functional calculations on (L2)(2)Cu-2. Treatment of the product from reaction of Cu-2(OAc)(4) and diacid H2L3 (Ar = 1,3-substituted 2,4-dibromophenyl) with pyridine gave a six-coordinate mononuclear chelate (L3)Py2Cu (.) H2O in which one chelate carboxylate is monodentate, the other is unsymmetrically bidentate, and the pyridines are cis-coordinated. (C) 2003 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2003.09.017