1-cyclopentadienyl-1-(6',6'-dimethylcyclohexadienyl)-2,5-bis(trimethylsilyl)-3,4-diphenylzirconacyclopentadiene | 461412-58-8

• 英文名称: 1-cyclopentadienyl-1-(6',6'-dimethylcyclohexadienyl)-2,5-bis(trimethylsilyl)-3,4-diphenylzirconacyclopentadiene
• CAS: 461412-58-8
• 化学式: C₃₅H₄₄Si₂Zr
• 分子量: 612.129
• InChiKey: XHMWFOZWAAZCBW-UHFFFAOYSA-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：

  bis(trimethylphosphine)(cyclopentadienyl)(6,6-dimethylcyclohexadienyl)zirconium 、 苯基乙炔基三甲基硅烷 以 正戊烷 为溶剂， 以30%的产率得到1-cyclopentadienyl-1-(6',6'-dimethylcyclohexadienyl)-2,5-bis(trimethylsilyl)-3,4-diphenylzirconacyclopentadiene
  参考文献：
  名称：

  Zr(C5H5)(6,6-dmch)(PMe3)2, an edge-bridged half-open zirconocene—synthesis, structure, and its reaction with C6H5C2SiMe3

  摘要：

  The synthesis and characterization of an edge-bridged half-open zirconocene, Zr(C5H5)(dmch)(PMe3)(2) (dmch = dimethylcyclo-hexadienyl), are described. As expected, the Zr-C bond distances for the dmch ligand are significantly shorter than those for the C5H5 ligand. The compound readily incorporates 2 equiv. of alkyne, with loss of the PMe3 ligands, leading to a zirconacyclopentadiene complex, so that the dmch ligand has remained intact. (C) 2002 Elsevier Science B.V. All rights reserved.

  DOI：

  10.1016/s0020-1693(02)00736-3