N-(pyridin-2-ylmethyl)-N,N'-(bis-(2-(pyridin-2-ylmethylthio))ethylethanamine) | 1374824-59-5

• 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: N-(pyridin-2-ylmethyl)-N,N'-(bis-(2-(pyridin-2-ylmethylthio))ethylethanamine)
• 英文别名: N-(pyridin-2-ylmethyl)-N,N'-(bis(2-pyridin-2-ylmethylthio))ethyethanamine；N-(pyridin-2-ylmethyl)-2-(pyridin-2-ylmethylsulfanyl)-N-[2-(pyridin-2-ylmethylsulfanyl)ethyl]ethanamine
• CAS: 1374824-59-5
• 化学式: C₂₂H₂₆N₄S₂
• 分子量: 410.607
• InChiKey: SXSXKPNFUSDJNR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  28
• 可旋转键数：
  12
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.32
• 拓扑面积：
  92.5
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  N-(pyridin-2-ylmethyl)-N,N'-(bis-(2-(pyridin-2-ylmethylthio))ethylethanamine) 、 cobalt(II) perchlorate hexahydrate 以 甲醇 为溶剂， 以70%的产率得到[cobalt(II)(N-(pyridin-2-ylmethyl)-N,N'-(bis(2-(pyridin-2-ylmethylthio))ethyethanamine)](perchlorate)2
  参考文献：
  名称：

  A novel hexadentate ligand and its complexes with divalent metal ions (Zinc, Copper, and Cobalt): Synthesis, characterization, and electrochemical investigation

  摘要：

  A novel hexadentate ligand, N-(pyridin-2-ylmethyl)-N,N'-(bis-(2-(pyridin-2-ylmethylthio))ethyethanamine) (L), containing "N4S2" donor-set was synthesized. Its reaction with one equivalent of divalent metal perchlorate salts, M(ClO4)(2)center dot 6H(2)O (M = Zn, Cu, and Co), in methanol yielded three mononuclear complexes [ML](ClO4)(2) (M = Zn, 1; Cu, 2; Co, 3) in octahedral geometry. The complexes were fully characterized and their structures were determined using X-ray single crystal diffraction analysis. UV-Vis spectra of the complexes revealed that metal-to-ligand charge transfer (MLCT) transition bands showed readily red-shift in the trend of Zn(II), Co(II), and Cu(II) complexes. Upon the divalent metal binding, the ligand-based reduction process shifted positively which, otherwise, is not observable in the electrochemical window. (C) 2012 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2012.01.032
• 作为产物：
  描述：

  2-氨甲基吡啶 在 sodium hydride 作用下， 以 四氢呋喃 、 甲苯 为溶剂， 反应 85.0h， 生成 N-(pyridin-2-ylmethyl)-N,N'-(bis-(2-(pyridin-2-ylmethylthio))ethylethanamine)
  参考文献：
  名称：

  A novel hexadentate ligand and its complexes with divalent metal ions (Zinc, Copper, and Cobalt): Synthesis, characterization, and electrochemical investigation

  摘要：

  A novel hexadentate ligand, N-(pyridin-2-ylmethyl)-N,N'-(bis-(2-(pyridin-2-ylmethylthio))ethyethanamine) (L), containing "N4S2" donor-set was synthesized. Its reaction with one equivalent of divalent metal perchlorate salts, M(ClO4)(2)center dot 6H(2)O (M = Zn, Cu, and Co), in methanol yielded three mononuclear complexes [ML](ClO4)(2) (M = Zn, 1; Cu, 2; Co, 3) in octahedral geometry. The complexes were fully characterized and their structures were determined using X-ray single crystal diffraction analysis. UV-Vis spectra of the complexes revealed that metal-to-ligand charge transfer (MLCT) transition bands showed readily red-shift in the trend of Zn(II), Co(II), and Cu(II) complexes. Upon the divalent metal binding, the ligand-based reduction process shifted positively which, otherwise, is not observable in the electrochemical window. (C) 2012 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2012.01.032

文献信息

• A novel hexadentate ligand and its complexes with divalent metal ions (Zinc, Copper, and Cobalt): Synthesis, characterization, and electrochemical investigation
  作者：Zhenhong Wei、Xiang Xie、Jia Zhao、Lingman Huang、Xiaoming Liu

  DOI：10.1016/j.ica.2012.01.032

  日期：2012.5

  A novel hexadentate ligand, N-(pyridin-2-ylmethyl)-N,N'-(bis-(2-(pyridin-2-ylmethylthio))ethyethanamine) (L), containing "N4S2" donor-set was synthesized. Its reaction with one equivalent of divalent metal perchlorate salts, M(ClO4)(2)center dot 6H(2)O (M = Zn, Cu, and Co), in methanol yielded three mononuclear complexes [ML](ClO4)(2) (M = Zn, 1; Cu, 2; Co, 3) in octahedral geometry. The complexes were fully characterized and their structures were determined using X-ray single crystal diffraction analysis. UV-Vis spectra of the complexes revealed that metal-to-ligand charge transfer (MLCT) transition bands showed readily red-shift in the trend of Zn(II), Co(II), and Cu(II) complexes. Upon the divalent metal binding, the ligand-based reduction process shifted positively which, otherwise, is not observable in the electrochemical window. (C) 2012 Elsevier B.V. All rights reserved.