Cp*IrCl₂(2,6-diethylphenylisocyanide)*CH2Cl2 | 1469885-93-5

• 英文名称: Cp*IrCl₂(2,6-diethylphenylisocyanide)*CH2Cl2
• CAS: 1469885-93-5
• 化学式: CH₂Cl₂*C₂₁H₂₈Cl₂IrN
• 分子量: 642.519
• InChiKey: FXEDMRWQIQUSGB-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

• 作为反应物：
  描述：

  Cp*IrCl₂(2,6-diethylphenylisocyanide)*CH2Cl2 、 sodium iodide 以 四氢呋喃 为溶剂， 反应 3.0h， 以95%的产率得到Cp*IrI2(2,6-diethylphenylisocyanide)
  参考文献：
  名称：

  Synthesis and characterization of a series of rhodium, iridium, and ruthenium isocyanide complexes

  摘要：

  Several new electrophilic metal isocyanide complexes have been fully characterized and reported herein. Isocyanide induced cleavage of the dimer, [LMCl2](2) {LM = Cp*Ir, Cp*Rh, or (p-cymene)Ru}, with 2, 6-xylylisocyanide or 2,6-diethylphenylisocyanide produces complexes of the general formula LM(CNAr)Cl-2. Halide metathesis of the dichloro complexes with sodium iodide produces the corresponding complexes with the general formula LM(CNAr)I-2. For the analogous ruthenium complexes better results were achieved via isocyanide induced cleavage of [(p-cymene)RuI2](2) and was synthesized differently from previous reports. Several neutral complexes in reaction with AgPF6 in acetonitrile form cationic, solvent-coordinated complexes have been fully characterized. Most reactions with rhodium decomposed to either [Cp*RhCl(MeCN)](2)[(PF6)(2)] starting from the dichloro complexes, or [Cp*Rh(MeCN)(3),(PF6)(2)] and Cp*Rh(CNAr)I-2 starting from the diiodo complexes. Several bases were probed to see if cyclization could be induced, but were not successful in any case. Many of these complexes have been characterized by single crystal X-ray crystallography. (c) 2013 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2013.07.039
• 作为产物：
  描述：

  bis[dichloro(pentamethylcyclopentadienyl)iridium(III)] 、 二氯甲烷 、 2,6-二乙基苯基异腈 以 四氢呋喃 为溶剂， 反应 1.0h， 以89%的产率得到Cp*IrCl₂(2,6-diethylphenylisocyanide)*CH2Cl2
  参考文献：
  名称：

  Synthesis and characterization of a series of rhodium, iridium, and ruthenium isocyanide complexes

  摘要：

  Several new electrophilic metal isocyanide complexes have been fully characterized and reported herein. Isocyanide induced cleavage of the dimer, [LMCl2](2) {LM = Cp*Ir, Cp*Rh, or (p-cymene)Ru}, with 2, 6-xylylisocyanide or 2,6-diethylphenylisocyanide produces complexes of the general formula LM(CNAr)Cl-2. Halide metathesis of the dichloro complexes with sodium iodide produces the corresponding complexes with the general formula LM(CNAr)I-2. For the analogous ruthenium complexes better results were achieved via isocyanide induced cleavage of [(p-cymene)RuI2](2) and was synthesized differently from previous reports. Several neutral complexes in reaction with AgPF6 in acetonitrile form cationic, solvent-coordinated complexes have been fully characterized. Most reactions with rhodium decomposed to either [Cp*RhCl(MeCN)](2)[(PF6)(2)] starting from the dichloro complexes, or [Cp*Rh(MeCN)(3),(PF6)(2)] and Cp*Rh(CNAr)I-2 starting from the diiodo complexes. Several bases were probed to see if cyclization could be induced, but were not successful in any case. Many of these complexes have been characterized by single crystal X-ray crystallography. (c) 2013 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2013.07.039