| 635685-07-3

• CAS: 635685-07-3
• 化学式: C₂₁H₄₅Cl₃CrN₃
• 分子量: 497.963
• InChiKey: BKAQNSAHGJGELL-UHFFFAOYSA-K

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为反应物：
  描述：

  、 N,N-二甲基苯铵四(五氟苯基)硼酸盐 以 甲苯 为溶剂， 以71%的产率得到
  参考文献：
  名称：

  Coordination chemistry of the activation of [(triazacyclohexane)CrCl3] with [PhNMe2H][B(C6F5)4] and AlR3

  摘要：

  Complexes of N-substituted 1,3,5-triazacyclohexanes with CrCl3 form 1:1 adducts with [PhNMe2H][B(C6F5)(4)] with increased solubility in toluene. Addition of (AlBu3)-Bu-i leads to free PhNMe2 and a complex with [B(C6F5)(4)](-) weakly coordinated to chromium via a meta-fluorine atom. This complex can polymerise and/or trimerise olefins similar to methyl aluminoxane activated complexes. Decomposition of the active complex involves transfer of the triazacyclohexane to aluminium leading to [(triazacyclohexane) (AlBu2)-Bu-i][B(C6F5)(4)] and [(arene)(2)Cr][B(C6F5)(4)]. These chromium(I) complexes have been characterised by X-ray crystallography and prove that chromium is reduced to the oxidation state +I during the catalysis. (C) 2003 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/s0022-328x(03)00634-x
• 作为产物：
  描述：

  trichlorotris(tetrahydrofuran)chromium(III) 、 1,3,5-tris(2-ethylbutyl)-1,3,5-triazinane 以 四氢呋喃 为溶剂， 以56%的产率得到
  参考文献：
  名称：

  Coordination chemistry of the activation of [(triazacyclohexane)CrCl3] with [PhNMe2H][B(C6F5)4] and AlR3

  摘要：

  Complexes of N-substituted 1,3,5-triazacyclohexanes with CrCl3 form 1:1 adducts with [PhNMe2H][B(C6F5)(4)] with increased solubility in toluene. Addition of (AlBu3)-Bu-i leads to free PhNMe2 and a complex with [B(C6F5)(4)](-) weakly coordinated to chromium via a meta-fluorine atom. This complex can polymerise and/or trimerise olefins similar to methyl aluminoxane activated complexes. Decomposition of the active complex involves transfer of the triazacyclohexane to aluminium leading to [(triazacyclohexane) (AlBu2)-Bu-i][B(C6F5)(4)] and [(arene)(2)Cr][B(C6F5)(4)]. These chromium(I) complexes have been characterised by X-ray crystallography and prove that chromium is reduced to the oxidation state +I during the catalysis. (C) 2003 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/s0022-328x(03)00634-x