| 1184721-46-7

• CAS: 1184721-46-7
• 化学式: C₂₄H₃₀Cl₂F₁₀Ir₂
• 分子量: 963.832
• InChiKey: UJLJBNSCDJIYGE-UHFFFAOYSA-L

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：

  iridium(3+);2-methylpropan-2-amine;1,1,1,2,2-pentafluoroethane;1,2,3,4,5-pentamethylcyclopenta-1,3-diene;chloride 生成
  参考文献：
  名称：

  具有Ir═N双键的单体全氟烷基铱（III）酰胺络合物及其在室温下活化sp 3碳氢键的反应

  摘要：

  使用X射线晶体学和DFT计算，已制备出一种简单的铱酰胺基络合物，并显示含有明确的Ir═N双键。通过激活末端烯烃的烯丙基C-H键在室温下，释放出的化合物表现出显着的反应性吨BuNH 2和形成η 3种铱-烯丙基配合物。

  DOI：

  10.1021/om900657f

文献信息

• Synthesis and crystallographic characterization of dimeric perfluoroalkyl iridium complexes: [Cp∗Ir(X)(RF)]2 (X = I, RF= CF3, CF2CF3, CF2CF2CF3, CF(CF3)2, CF(CF3)(CF2CF3); X = Cl and Br, RF= CF2CF3), and a new perfluoroethylidene complex Cp∗Ir(PPh3)(CFCF3)
  作者：Jian Yuan、Russell P. Hughes、Arnold L. Rheingold

  DOI：10.1016/j.ica.2010.06.006

  日期：2010.12

  Monomeric perfluoroalkyl-iridium complexes IrCp*(R-F)(CO)I react with N-methylmorpholine-N-oxide (NMO) with loss of the CO ligand, and clean formation of stable red iodide-bridged dimers, all of which have characterized in solution by H-1 and F-19 NMR spectroscopy and in the solid state by X-ray diffraction. Dimeric perfluoroethyl analogues with chloro and bromo ligands have also been prepared. Reaction of these iodo-bridged dimers with acetonitrile, ethylene and amines forms the corresponding monomeric complexes in solution but coordination is weak and reversible. CO reacts irreversibly to afford the monomeric starting materials, while PMe3 and PPh3 yield monomeric phosphine complexes, which can be reduced to give perfluoroethylidene compounds. (C) 2010 Elsevier B.V. All rights reserved.