(η5-C4H5S)Mo(P(CH3)3)3(κ1-O2CCF3) | 433285-14-4

• 英文名称: (η5-C4H5S)Mo(P(CH3)3)3(κ1-O2CCF3)
• CAS: 433285-14-4
• 化学式: C₁₅H₃₂F₃MoO₂P₃S
• 分子量: 522.34
• InChiKey: HNLHLHPFPMTKHO-GLUPTGNJSA-L

计算性质

• 辛醇/水分配系数(LogP)：
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• 重原子数：
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• 可旋转键数：
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• 环数：
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• sp3杂化的碳原子比例：
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• 拓扑面积：
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• 氢给体数：
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• 氢受体数：
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反应信息

• 作为产物：
  描述：

  (η5-C4H5S)Mo(P(CH3)3)2(η2-CH2P(CH3)2) 、 三氟乙酸 以 not given 为溶剂， 生成 (η5-C4H5S)Mo(P(CH3)3)3(κ1-O2CCF3)
  参考文献：
  名称：

  Thiophene and Butadiene−Thiolate Complexes of Molybdenum:  Observations Relevant to the Mechanism of Hydrodesulfurization

  摘要：

  Mo(PMe3)6 reacts with thiophene to give the eta5-thiophene complex (eta5-C4H4S)Mo(PMe3)3 and the eta5-butadiene-thiolate complex (eta5-C4H5S)Mo(PMe3)2(eta2-CH2PMe2), which are the first examples of (i) eta5-thiophene coordination and (ii) C-S cleavage and hydrogenation by a molybdenum compound. Deuterium labeling studies suggest that the hydrogenation of thiophene may involve an alkylidene intermediate, an observation that has ramifications for the mechanisms of hydrodesulfurization.

  DOI：

  10.1021/ja012771o