[(η5-indenyl)Ru(CO)3] | 1105614-33-2

• 英文名称: [(η5-indenyl)Ru(CO)3]
• 英文别名: [(Ind)Ir(CO)3](1+)
• CAS: 1105614-33-2
• 化学式: C₁₂H₇O₃Ru
• 分子量: 300.256
• InChiKey: OMSCPRJWGLPMKY-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

• 作为反应物：
  描述：

  [(η5-indenyl)Ru(CO)3] 在 cobaltocene 作用下， 以 acetone 为溶剂， 生成 [(η5-indenyl)Ru(CO)]2(μ-CO)2
  参考文献：
  名称：

  On the Nature of the Formation of [(η⁵-Ind)Ru(CO)₂H]: Evidence of a Water-Gas Shift Reaction Mechanism via Triethylamine Reduction

  摘要：

  The formation of [(eta(5)-Ind)Ru(CO)(2)H] from [(eta(5)-Ind)Ru(CO)(3)](+) was investigated using both H-1 and H-2 NMR spectroscopy and GC-mass spectrometry. Both NMR and GC-MS data support a water-gas shift reaction mechanism as the cause for formation of [(eta(5)-Ind)Ru(CO)(2)H].

  DOI：

  10.1021/om9010774

文献信息

• Chemical, Electrochemical, and Theoretical Investigations of [(Cp)Ru(CO)₃]⁺ and [(Ind)Ru(CO)₃]⁺
  作者：Robert C. Badger、Jason S. D’Acchioli、Benjamin C. Gamoke、Sang Bok Kim、Tracey A. Oudenhoven、Dwight A. Sweigart、Robin S. Tanke

  DOI：10.1021/om800767g

  日期：2009.1.26

  The complexes [(Cp)Ru(CO)(3)](+) and [(Ind)Ru(CO)(3)](+) were subjected to chemical, electrochemical, and spectroelectrochemical investigations in an attempt to gauge their similarity to [(Cp)Fe(CO)(3)](+) and [(Ind)Fe(CO)(3)](+). While the Fe complexes exhibited reversible electrochemical behavior-the indene analogue exhibiting a so-called "inverse indenyl effect"-the Ru complexes exhibited limited electrochernical reversibility, even at -30 degrees C and higher scan rates. The formation of the hydride complexes [(Cp)Ru(CO)(2)H] and [(Ind)Ru(CO)(2)H] was observed via H-1 NMR and IR. The X-ray crystal structure of [(Ind)Ru(CO)(3)](+) is presented here for the first time.