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| 157204-89-2

中文名称
——
中文别名
——
英文名称
——
英文别名
——
化学式
CAS
157204-89-2
化学式
C42H52N2O4Ru2
mdl
——
分子量
851.026
InChiKey
LHIWPBVDMOXJIC-OCXSIEGFSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

反应信息

  • 作为产物:
    描述:
    十二羰基三钌 、 (S)-1-(1-dimethylaminoethyl)-2-(2,3,4,5-tetramethylcyclopenta-1,3-dienyl)benzene 在 air 作用下, 以 正庚烷 为溶剂, 以4%的产率得到
    参考文献:
    名称:
    Chiral cyclopentadienyl catalysts. Part 3. Synthesis and reactions of (S)-1-(1-dimethylaminoethyl)-2-(2,3,4,5-tetramethylcyclopenta-1,3-dienyl)benzene; crystal structure of [Rh{η5-C5Me4C6H4CH(Me)NMe2}Cl2]
    摘要:
    The synthesis of (S)-1-(1-dimethylaminoethyl)-2-(2,3,4,5-tetramethylcyclopenta-1,3-dienyl)benzene (HL) and its reactions with [Ru3(CO)12] and IrCl3.3H2O have been performed. Compound HL also reacts with RhCl3.3H2O to give a mixture of [Rh{eta5-C5Me4C6H4CH(Me)NMe2}Cl2] 1 and [{Rh[eta5-C5Me4C6H4CH(Me)NMe2.HCl]Cl2}2] 2. A single-crystal X-ray diffraction study of 1 was carried out: the compound crystallises in the orthorhombic, space group P2(1)2(1)2(1) (D(2)4, no. 19) with a = 8.691 (6), b = 15.803(15), c = 13.840(10) angstrom and Z = 4; R = 0.0657. Interconversion between 1 and 2 can be effected readily using HCl or base respectively. Other aspects of the chemistry of 1 have been investigated including its conversion into [Rh{eta5-C5Me4C6H4CH(Me)NMe2}(C2H4)2] in which rotation of the co-ordinated ethene molecules has been estimated by H-1 NMR spectroscopy to have a free energy of activation (DELTAG(double dagger)) = 67.2 kJ mol-1. In contrast to 1, the methylated derivative [Rh{eta5-C5Me4C6H4CH(Me)NMe3+BF4-}Cl2] functions as a hydrogenation catalyst but with prochiral alkenes the optical yields were low (less-than-or-equal-to 8% enantiomeric excess).
    DOI:
    10.1039/dt9940001445
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