bisbenzoylhydrazone of 2,6-diformyl-4-CH2Ph-phenol | 339574-29-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: bisbenzoylhydrazone of 2,6-diformyl-4-CH2Ph-phenol
• 英文别名: N-[[3-[(benzoylhydrazinylidene)methyl]-5-benzyl-2-hydroxyphenyl]methylideneamino]benzamide
• CAS: 339574-29-7
• 化学式: C₂₉H₂₄N₄O₃
• 分子量: 476.535
• InChiKey: MSZZRZWDRJEECZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.3
• 重原子数：
  36
• 可旋转键数：
  8
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.03
• 拓扑面积：
  103
• 氢给体数：
  3
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  甲醇 、 bisbenzoylhydrazone of 2,6-diformyl-4-CH2Ph-phenol 、 copper(II) nitrate 以 甲醇 为溶剂， 生成 [(bisbenzoylhydrazone of 2,6-diformyl-4-CH2Ph-phenolate)(CH3O)(Cu(II))2](NO3)2 complex
  参考文献：
  名称：

  摘要：

  A series of binuclear Cu(II) complexes with bisbenzoylhydrazones of 2,6-diformyl-4-R-phenols (R = OCH3, CH3, CH2Ph, Cl, Br, CO2CH3) with H2LCu2(NO3)(2)(OCH3) composition, where H2L- are monodeprotonated bishydrazones, was synthesized. The structure of the obtained complexes was established using IR spectroscopy and conductometric and magnetochemical data. The title complexes were shown to exhibit exchange interaction of the antiferromagnetic type. Results of quantum-chemical calculations of structures modeling the state of a ligand in the complex were used to discuss the effect of substituent R nature on magnetic exchange in the complexes.

  DOI：

  10.1023/a:1009587502176