bis(salicylato)-di(nicotinamide) copper(II) | 158443-73-3

• 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: bis(salicylato)-di(nicotinamide) copper(II)
• 英文别名: bis(salicylato)bis(nicotinamide)copper(II)；copper;2-hydroxybenzoate;pyridine-3-carboxamide
• CAS: 158443-73-3；638166-22-0
• 化学式: C₂₆H₂₂CuN₄O₈
• 分子量: 582.029
• InChiKey: SNBCKLFIQZVBFG-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  -0.13
• 重原子数：
  39
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  233
• 氢给体数：
  4
• 氢受体数：
  10

反应信息

• 作为产物：
  描述：

  copper(II) salicylate tetrahydrate 、 烟酰胺 以 甲醇 、 乙腈 为溶剂， 生成 bis(salicylato)-di(nicotinamide) copper(II)
  参考文献：
  名称：

  Bis(nicotinamide-N)bis(salicylato-O,O')copper(II), the Monoclinic Form

  摘要：

  The monoclinic form of the title compound, [Cu(C7H5O3)(2)(C6H6N2O)(2)], was isolated during the systematic synthesis of copper salicylates. A distorted octahedral coordination around Cu-II, located on the centre of symmetry, is formed by four carboxylic O atoms from two salicylate ligands [Cu-O 1.928 (2) and 2.766 (2) Angstrom] and by two N atoms from two nicotinamide groups [Cu-N 2.022 (2) Angstrom]. Monomeric structural units are linked together via hydrogen bonds of the type N-H ... O between the N and O atoms of the nicotinamide ligands.

  DOI：

  10.1107/s010827019700615x

文献信息

• Hoang, Nam Nhat; Valach, Fedor; Melnik, Milan, Zeitschrift fur Kristallographie
  作者：Hoang, Nam Nhat、Valach, Fedor、Melnik, Milan

  DOI：——

  日期：——