| 1256377-87-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• CAS: 1256377-87-3
• 化学式: C₁₆H₃₆N*C₂₈H₁₂Br₈NiS₄
• 分子量: 1417.06
• InChiKey: HBZSTAJVTZMNKQ-YKAYHTPVSA-J

计算性质

• 辛醇/水分配系数(LogP)：
  18.31
• 重原子数：
  58.0
• 可旋转键数：
  16.0
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  0.0
• 氢给体数：
  0.0
• 氢受体数：
  4.0

反应信息

• 作为产物：
  描述：

  tetraphosphorus decasulfide 、 nickel(II) chloride hexahydrate 、 3,3',5,5'-tetrabromobenzil 、 3,3',5,5'-tetrabromobenzoin 、 四丁基溴化铵 以 1,4-二氧六环 、 水 为溶剂， 以48%的产率得到
  参考文献：
  名称：

  Synthesis, characterization, spectroscopy, electronic and redox properties of a new nickel dithiolene system

  摘要：

  A new dithiolene ligand with 3,5-dibromo substituted phenyl groups was designed and synthesized. The protected form of the ligand was reacted with a nickel salt providing neutral Ni(S(2)C(2)(3,5-C(6)H(3)Br(2))(2))(2) and anionic [Ni(S(2)C(2)(3,5-C(6)H(3)Br(2))(2))(2)] isolated as a Bu(4)N(+) salt. Both were characterized by UV-Vis and IR spectroscopy and compared with the similar known molecular systems. They exhibit intense low energy transitions that are characteristic of such systems. The electrochemical behavior of these molecules was investigated by cyclic voltammetry. (C) 2010 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2010.04.004