[Ir(N(C6H4PPh2)(CH2CH2NEt2))(COD)] | 1264268-20-3

• 英文名称: [Ir(N(C6H4PPh2)(CH2CH2NEt2))(COD)]
• 英文别名: [Ir(I)(N-(2-diphenylphosphinophenyl)-N',N'-diethylethane-1,2-diamine-κ2P,N)(1,5-cyclooctadiene)]
• CAS: 1264268-20-3
• 化学式: C₃₂H₄₀IrN₂P
• 分子量: 675.877
• InChiKey: XEALLKWZGORQAQ-GHDUESPLSA-N

计算性质

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

• 作为产物：
  描述：

  (1,5-cyclooctadiene)(methoxy)iridium(I) dimer 、 N-(2-(diphenylphosphino)phenyl)-N',N'-diethylethane-1,2-diamine 以 乙醚 为溶剂， 以83%的产率得到[Ir(N(C6H4PPh2)(CH2CH2NEt2))(COD)]
  参考文献：
  名称：

  Tunable Hemilabile Ligands for Adaptive Transition Metal Complexes

  摘要：

  A new family of monoanionic hemilabile ligands L1H-L3H with a PNN donor set has been developed, based on Pd-catalyzed C-N bond formation and straightforward phosphorylation. For these structurally related compounds with a hybrid set of donor atoms, the coordination chemistry with both Rh and Ir has been studied. The anticipated hemilabile character of the dimethylamino group was assessed by NMR and IR competition experiments, using isopropyl isocyanide as exogenous substrate. Supporting DFT calculations were used to quantify the electronic differences between the various members of the ligand family. In effect, we have constructed a modular ligand class that exhibits tunable hemilability.

  DOI：

  10.1021/om100804k