[(η5-C5Me5)Ir[μ-η2:η3-3-thiapentane-1,5-dithiolate](η5-C5Me5)IrCl][(η5-C5Me5)IrCl3] | 1351452-12-4

• 英文名称: [(η5-C5Me5)Ir[μ-η2:η3-3-thiapentane-1,5-dithiolate](η5-C5Me5)IrCl][(η5-C5Me5)IrCl3]
• 英文别名: [Cp*Ir[μ-η2:η3-C4H8S3]Cp*IrCl][Cp*IrCl3]
• CAS: 1351452-12-4
• 化学式: C₁₀H₁₅Cl₃Ir*C₂₄H₃₈ClIr₂S₃
• 分子量: 1276.46
• InChiKey: BJXXEZQFEVYCOC-UHFFFAOYSA-H

计算性质

• 辛醇/水分配系数(LogP)：
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• 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：

  bis[dichloro(pentamethylcyclopentadienyl)iridium(III)] 、 (η5-C5Me5)Ir(η3-3-thiapentane-1,5-dithiolate) 以 丙酮 为溶剂， 以79%的产率得到[(η5-C5Me5)Ir[μ-η2:η3-3-thiapentane-1,5-dithiolate](η5-C5Me5)IrCl][(η5-C5Me5)IrCl3]
  参考文献：
  名称：

  New thioether–dithiolate complexes of Cp∗Ir and some reactivity features

  摘要：

  The reaction of [Cp*IrCl2](2) (Cp* = eta(5) - C5Me5) with the tridentate 3-thiapentane-1,5-dithiolate ligand, S(CH2CH2S-)(2) (tpdt), led to the formation of [Cp*Ir(eta(3) - tpdt)] (1) in 81% isolated yield. Subsequent reactions of 1 with [Cp*IrCl2](2) in 2:1 and 1:1 molar equiv ratios resulted in the formation of [Cp*Ir(mu - eta(2):eta(3) - tpdt) Cp*IrCl][PF6] (2) and [Cp*Ir mu - eta(2):eta(3) - tpdt) Cp*IrCl][Cp*IrCl3] (3) in 86 and 79% yields, respectively, based on 1, whereas the reactions of 1 with [(COD) IrCl](2) (COD = 1,5-cyclooctadiene) in 2:1 and 1:1 molar equiv ratios resulted in the formation of the homo-bimetallic derivatives Cp*Ir(mu - eta(1):eta(3) - tpdt)(COD)IrCl (4) (92% yield) and [Cp*Ir(mu - eta(2):eta(3) - tpdt)(COD)Ir] [(COD)IrCl2] (5) (82% yield). Reactions between 1 and [(COD)RhCl](2), yielded the hetero-bimetallic derivatives Cp*Ir(mu - eta(1):eta(3) - tpdt)(COD)RhCl (6) and [Cp*Ir(mu - eta(2):eta(3) - tpdt)(COD)Rh][(COD)RhCl2] (7), in 92 and 93% yields, respectively. The reaction of 1 with methyl iodide gave mono-methylated derivative [Cp*Ir(eta(3) - C4H8S3Me)]I (8) (93% yield). All these compounds have been comprehensively characterized. (C) 2011 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jorganchem.2011.09.012