[(tert-butylphosphine)(η5-cyclopentadienyl)Mn(μ-tert-butylphosphide)2Mn(η5-cyclopentadienyl)(tert-butylphosphine)] | 1352804-14-8

• 英文名称: [(tert-butylphosphine)(η5-cyclopentadienyl)Mn(μ-tert-butylphosphide)2Mn(η5-cyclopentadienyl)(tert-butylphosphine)]
• CAS: 1352804-14-8
• 化学式: C₂₆H₅₂Mn₂P₄
• 分子量: 598.47
• InChiKey: PDKHKWBERJSPSO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 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：
  None
• 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：

  双(环戊二烯)锰 、 叔丁基膦 以 四氢呋喃 为溶剂， 以31%的产率得到[(tert-butylphosphine)(η5-cyclopentadienyl)Mn(μ-tert-butylphosphide)2Mn(η5-cyclopentadienyl)(tert-butylphosphine)]
  参考文献：
  名称：

  Structure and Bonding of the Manganese(II) Phosphide Complex (t-BuPH₂)(η⁵-Cp)Mn{μ-(t-BuPH)}₂Mn(Cp)(t-BuPH₂)

  摘要：

  Rather than achieving bis-deprotonation of the phosphine, reaction of Cp2Mn (Cp = cydopentadienyl) with t-BuPH2 at room temperature yields monodeprotonation of half of the available phosphine in the product (t-BuPH2)(eta(5)-Cp)Mn{mu-(t-BuPH)}(2)Mn(Cp)(t-BuPH2) (1). This complex comprises a Mn(II) phosphide and is a dimer in the solid state, containing a Mn2P2 diamond core. Consistent with the observation of a relatively short intermetal distance of 2.8717(4) angstrom in 1, DFT analysis of the full structure points to a singlet ground state stabilized by a direct Mn-Mn single bond. This is in line with the diamagnetic character of 1 and an 18-electron count at Mn.

  DOI：

  10.1021/om200381p