(3-tert-butylcyclopenta-2,4-dien-1-yl)-cyclopenta-2,4-dien-1-yl-dimethylgermane;dichlorozirconium(2+) | 347360-79-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: (3-tert-butylcyclopenta-2,4-dien-1-yl)-cyclopenta-2,4-dien-1-yl-dimethylgermane;dichlorozirconium(2+)
• CAS: 347360-79-6
• 化学式: C₁₆H₂₂Cl₂GeZr
• 分子量: 449.071
• InChiKey: XRPVZWREMQQJTN-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  4.62
• 重原子数：
  20
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  zirconium chloride-tetrahydrofuran 、 (3-Tert-butylcyclopenta-2,4-dien-1-yl)-cyclopenta-2,4-dien-1-yl-dimethylgermane 在 C₄H₉Li 作用下， 以 四氢呋喃 、 正己烷 为溶剂， 以8%的产率得到(3-tert-butylcyclopenta-2,4-dien-1-yl)-cyclopenta-2,4-dien-1-yl-dimethylgermane;dichlorozirconium(2+)
  参考文献：
  名称：

  Synthesis, structures and polymerization catalytic properties of germyl-bridged bis(cyclopentadienyl) metallocenes

  摘要：

  The ansa-metallocene complexes Me2Ge(eta(5)-C5Me4)(2)MCl2 [M = Ti (1), Zr (2)], Me2Ge(eta(5)-C5H3Bu-t)(2)ZrCl2 (3) and Me2Ge(eta(5)-C5H4)(eta(5)-C5H3R)ZrCl2 [R = Me (4), t-Bu (5)] were prepared by the reaction of the corresponding ligands with n-BuLi and MCl4.2THF, respectively. The molecular structures of 1 and 2 have been determined by the X-ray diffraction method. Complexes 2-5 in combination with MAO were studied as catalysts for ethylene polymerization and all the germyl-bridged zirconocene catalysts show high activities at relative high temperatures. This indicates that the germyl-bridged zirconocene systems show thermally stable catalyst systems for polymerization of ethylene. (C) 2002 Elsevier Science B.V. All rights reserved.

  DOI：

  10.1016/s0022-328x(01)01396-1