6-chloro-1,1-bis(trimethylphosphine-P)-1-endo-H-2,3-dicarba-1-irida-isonido-undecaborane(12) | 189138-96-3

• 英文名称: 6-chloro-1,1-bis(trimethylphosphine-P)-1-endo-H-2,3-dicarba-1-irida-isonido-undecaborane(12)
• CAS: 189138-96-3
• 化学式: C₈H₂₈B₈ClIrP₂
• 分子量: 500.419
• InChiKey: DDTZQFRDTFXBHB-ZXNHFCIYSA-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：

  arachno-IrH(PMe3)2(CO)B8H11Cl 、 乙炔 以 xylene 为溶剂， 生成 nido-Ir(PMe3)2(CO)C2B8H10Cl 、 6-chloro-1,1-bis(trimethylphosphine-P)-1-endo-H-2,3-dicarba-1-irida-isonido-undecaborane(12)
  参考文献：
  名称：

  Theisonido-Metalladicarbaborane [1,1,1-H{P(CH₃)₃}₂-6-Cl-1,2,4-IrC₂B₈H₉]

  摘要：

  A single-crystal diffraction study of the title iridadicarbaundecaborane species, 6-chloro-1,1-bis(trimethylphosphine-P)-1-endo-H-2,3-dicarba-1-irida-isonido-undecaborane(12), [IrH(PMe3)(2)(C2B8H9Cl)] or [(PMe3)(2)-(H)IrC2B8H9Cl], shows that it has an isonido-type structure with a four-membered Irl-C2-C4-B7 open face. The presence of the chlorine substituent on vertex B6 suggests that the compound is formed via a simple ligand elimination and intrafacial addition of the metal vertex to a neighbouring boron vertex in the probable precursor compound nido-[(PMe3)(2)(CO)IrC2B8H10Cl].

  DOI：

  10.1107/s0108270196014199