[Ti(η(5)-C5H4SiMe2[η(1)-N(2,6-Me2C6H3)])(CH2B(C6F5)2)(C6F5)] | 252189-25-6

• 英文名称: [Ti(η(5)-C5H4SiMe2[η(1)-N(2,6-Me2C6H3)])(CH2B(C6F5)2)(C6F5)]
• CAS: 252189-25-6
• 化学式: C₃₄H₂₁BF₁₅NSiTi
• 分子量: 815.3
• InChiKey: JUBPLQSFBLNNQI-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：

  [Ti(η(5)-C5H4SiMe2[η(1)-N(2,6-Me2C6H3)])Me(MeB(C6F5)3)] 以 甲苯 为溶剂， 以83%的产率得到[Ti(η(5)-C5H4SiMe2[η(1)-N(2,6-Me2C6H3)])(CH2B(C6F5)2)(C6F5)]
  参考文献：
  名称：

  Cationic species derived from the η1-amidosilyl-η5-cyclopentadienyl dimethyl titanium complex. Crystal structure of [Ti{η5-C5H4SiMe2[η1-N(2,6-Me2C6H3)]}{CH2B(C6F5)2}(C6F5)]

  摘要：

  Reactions of the eta(5)-cyclopentadienyl-eta(1)-amido dimethyl titanium derivative [Ti{eta(5)-C5H4SiMe2[eta(1)-N(C6H3Me2)]}Me-2] (1) with tris(pentafluorophenyl)borane B(C6F5)(3) in hexane at room temperature yield a thermally stable bright yellow microcrystaline solid identified by elemental analysis as [Ti{eta(5)-C5H4SiMe2[eta(1)-N(C6H3Me2)]}Me{MeB(C6F5)(3)}] (2). A solution of 1 in CD2Cl2 at -78 degrees C affords the ion-pair complex 2, while in C6D6 it is slowly converted into the new neutral complex [Ti{eta(5)-C5H4SiMe2[eta(1)-N(C6H3Me2)]}{CH2B(C6F5)(2)}(C6F5)] (3). Complex 3 is the unique product obtained after stirring compound 2 or a mixture of complex 1 and B(C6F5)(3) in toluene or benzene for 12 h at room temperature. The molecular structure of complex 3 has been determined by diffraction methods. (C) 1999 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0022-328x(99)00340-x