[Ir(ethylene)2(N,N,N',N'-tetramethylethylenediamine)(acetonitrile)][BF4] | 1073152-72-3

• 英文名称: [Ir(ethylene)2(N,N,N',N'-tetramethylethylenediamine)(acetonitrile)][BF4]
• 英文别名: [Ir(ethylene)2(TMEDA)(MeCN)][BF4]
• CAS: 1073152-72-3
• 化学式: BF₄*C₁₂H₂₇IrN₃
• 分子量: 492.391
• InChiKey: LPDJAQUSDXPUJZ-UHFFFAOYSA-N

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：

  氟硼酸钠 、 四甲基乙二胺 、 [Ir(η2-ethylene)2Cl]2 、 乙腈 以 乙腈 为溶剂， 生成 [Ir(ethylene)2(N,N,N',N'-tetramethylethylenediamine)(acetonitrile)][BF4]
  参考文献：
  名称：

  C–S bond cleavage of 2-methoxythiophene by Ir–TMEDA complex (TMEDA =N,N,N’,N’-tetramethylethylenediamine). Formation of novel dinuclear iridathiacyclohexenyl complex

  摘要：

  The Ir-TMEDA complex [Ir(C2H4)(2)(TMEDA)(MeCN)][BF4] (TMEDA = Me2NCH2CH2NMe2) was treated with 2-methoxythiophene in MeCN at 70 degrees C in the presence of H2O to afford the novel dinuclear iridathiacyclohexenyl complex [Ir-2{C(OMe)CHCHCH(CMe=NH)S}(MeCONH)(TMEDA)(2)][BF4](2) in 42% yield, in which two Ir(TMEDA) fragments, one 2-methoxythiophene, and two MeCN molecules are incorporated together with one H2O molecule. The mechanism that involves the insertion of the Ir center into the thiophenic S-C(OMe) bond followed by the pi-coordination of the second Ir center to the thiametallacycle has been proposed. (C) 2008 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jorganchem.2008.07.013