| 84333-17-5

• CAS: 84333-17-5
• 化学式: C₅H₆FeO₃
• 分子量: 169.948
• InChiKey: GLNQQCFBLATUHQ-UHFFFAOYSA-N

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

• 作为产物：
  描述：

  Fe(CO3)3(η2-ethene) 、 氢气 以 gas 为溶剂， 生成
  参考文献：
  名称：

  A study of the kinetics of reaction of iron tricarbonyl and Fe(CO)3(L) with hydrogen and ethene for L = hydrogen and ethene by transient Infrared spectroscopy: reactions relevant to olefin hydrogenation kinetics

  摘要：

  The reactions of Fe(CO)3 with ethylene and H-2 have been studied and rate constants for the formation of the H2Fe(CO)3 and Fe(CO)3(ethylene) complexes have been obtained. Further reactions of these unsaturated products with ethylene and H-2 respectively have been shown to lead to formation of the H2Fe(CO)3(ethylene) complex which is a crucial intermediate in the proposed mechanism for Fe(CO)3-induced hydrogenation of ethylene. The rate constants for formation of this complex from both precursors have been obtained and are reported along with the other rate constants determined in this study. Interestingly, though ethane is produced on a long time scale under the experimental conditions, H2Fe(CO)3(ethylene) is stable at room temperature in the approximately 100-mu-s observation time of these experiments. Significant differences have been observed for the rate constants of formation of the various complexes that were studied. These variations are discussed with respect to spin allowed versus disallowed reactions and the nature of the reacting ligand.

  DOI：

  10.1021/j100160a020