[iridium(I)(η2,η2-C8H12)(1,10-phenantroline)(CCPh)] | 56764-64-8

• 英文名称: [iridium(I)(η2,η2-C8H12)(1,10-phenantroline)(CCPh)]
• CAS: 56764-64-8
• 化学式: C₂₈H₂₅IrN₂
• 分子量: 581.74
• InChiKey: GXFDKMNAJIYOFE-KEUNEWJHSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为产物：
  描述：

  氯（1,5-环辛二烯）（1,10-菲咯啉）铱（I）四氢呋喃加合物 、 苯乙炔 以 氘代甲醇 为溶剂， 生成 [iridium(I)(η2,η2-C8H12)(1,10-phenantroline)(CCPh)] 、 [iridium(I)(η1,η3-C8H12)(1,10-phenantroline)(CCPh)]
  参考文献：
  名称：

  Organoiridium compounds with substituted phenantrolines as alkynes polymerization catalysts

  摘要：

  The iridium derivatives [Ir(diene)(N-N)X] (diene=1,5-cyclooctadiene, 1,5-hexadiene; N-N=1,10-phenantroline, 4,7-dimethyl-1,10-phenantroline, 3,4,7,8-tetramethyl-1,10-phenantroline, 4,7-diphenyl-1,10-phenantroline; X=Cl, Br, I) catalyze the polymerization of pheny- lacetylene. The reaction is highly stereoselective with formation of 100% trans-polyphenylacetylene. The catalytic activity has a pronounced dependence upon the choice of the ligands coordinated to iridium: effect of nature of the diene, of the phenantroline, of the halogen, as well as of the reaction conditions (solvent, temperature, presence of a cocatalyst) have been examined in detail. The evolution of the catalyst precursors after addition of the alkyne has been studied by NMR; the results evidence a different behaviour of cyclooctadiene and hexadiene derivatives, which can be related to the differences observed in the catalytic reactions. (c) 2005 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.molcata.2005.05.016