[CdCl(3-pyridin carboxylic acid)] | 1338323-86-6

• 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: [CdCl(3-pyridin carboxylic acid)]
• CAS: 1338323-86-6
• 化学式: C₆H₄NO₂*Cd*Cl
• 分子量: 269.966
• InChiKey: SNTJLERAHIVJQJ-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  -3.55
• 重原子数：
  11.0
• 可旋转键数：
  1.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  53.02
• 氢给体数：
  0.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  [CdCl(3-pyridin carboxylic acid)] 以 neat (no solvent) 为溶剂， 生成 cadmium(II) oxide
  参考文献：
  名称：

  Preparation of metal Niacin complexes and characterization using spectroscopic and electrochemical techniques

  摘要：

  Metal complexes of Niacin (3-pyridin carboxylic acid) were prepared in aqueous medium and characterized by different physico-chemical methods. On the basis of elemental analysis the empirical formula of the complexes have been proposed as [Fe(C(6)H(4)NO(2))]Cl(2), [Co(C(6)H(4)NO(2))]Cl, [Zn(C(6)H(4)NO(2))]Cl, [Cd(C(6)H(4)NO(2))]Cl and [Hg(C(6)H(4)NO(2))]Cl. IR spectral data indicate that the metal-ligand bonding occurs through nitrogen atom of aromatic ring and oxygen atom of COO-group. UV-visible spectra show that Fe(III) and Co(II) complexes show d-d electronic transition in addition to pi -> pi*, n -> pi* and n -> sigma* transitions. The Fe(II) and Co(II) complexes are paramagnetic. QSTG analysis data strongly support the absence of water molecules in the complexes, and the weight of the residue corresponds to the respective metal oxides. Cyclic voltammetric studies suggest that the redox properties of Zn(II), Cd(II) and Hg(II) in their complexes are modified compared to the uncoordinated metal ion. The CV data also indicate that the charge transfer processes are not reversible.

  DOI：

  10.1134/s0036023611090154
• 作为产物：
  描述：

  烟酸 、 cadmium(II) chloride 以 水 为溶剂， 生成 [CdCl(3-pyridin carboxylic acid)]
  参考文献：
  名称：

  Preparation of metal Niacin complexes and characterization using spectroscopic and electrochemical techniques

  摘要：

  Metal complexes of Niacin (3-pyridin carboxylic acid) were prepared in aqueous medium and characterized by different physico-chemical methods. On the basis of elemental analysis the empirical formula of the complexes have been proposed as [Fe(C(6)H(4)NO(2))]Cl(2), [Co(C(6)H(4)NO(2))]Cl, [Zn(C(6)H(4)NO(2))]Cl, [Cd(C(6)H(4)NO(2))]Cl and [Hg(C(6)H(4)NO(2))]Cl. IR spectral data indicate that the metal-ligand bonding occurs through nitrogen atom of aromatic ring and oxygen atom of COO-group. UV-visible spectra show that Fe(III) and Co(II) complexes show d-d electronic transition in addition to pi -> pi*, n -> pi* and n -> sigma* transitions. The Fe(II) and Co(II) complexes are paramagnetic. QSTG analysis data strongly support the absence of water molecules in the complexes, and the weight of the residue corresponds to the respective metal oxides. Cyclic voltammetric studies suggest that the redox properties of Zn(II), Cd(II) and Hg(II) in their complexes are modified compared to the uncoordinated metal ion. The CV data also indicate that the charge transfer processes are not reversible.

  DOI：

  10.1134/s0036023611090154