[(η5-((i-Pr)2PC5H4)Fe-η5:η5-(C5H4P(Ph)C5H4)Fe(η5-C5H4P(i-Pr)2)RuCl2(C6H5CH2CN)] | 402520-45-0

• 英文名称: [(η5-((i-Pr)2PC5H4)Fe-η5:η5-(C5H4P(Ph)C5H4)Fe(η5-C5H4P(i-Pr)2)RuCl2(C6H5CH2CN)]
• CAS: 402520-45-0
• 化学式: C₄₆H₅₆Cl₂Fe₂NP₃Ru
• 分子量: 999.549
• InChiKey: HYILMLHAAXMVDL-UHFFFAOYSA-L

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：
  None

反应信息

• 作为产物：
  描述：

  RuCl2(bis-1-(1'-diisopropylphosphinoferrocenyl)phenylphosphine) 、 苯乙腈 以 氘代氯仿 为溶剂， 生成 [(η5-((i-Pr)2PC5H4)Fe-η5:η5-(C5H4P(Ph)C5H4)Fe(η5-C5H4P(i-Pr)2)RuCl2(C6H5CH2CN)]
  参考文献：
  名称：

  Diferrocenyltriphosphines 2. Reversible phosphine deligation in the chemistry of diferrocenyltriphosphine Ru(II) dichloride complexes with nitriles and pyridines: towards a pH-switchable catalyst?

  摘要：

  The reaction of the complexes [P-3-(P(3)fc(2))RuCl2] P(3)fc(2) = [eta (5)-(R(2)pC(5)H(4))Fe-eta (5):eta (5)-(C5H4P(R')C5H4)Fe(eta (5)-C5H4PR2)], R, R'= Ph, iPr with linear nitriles results in the formation of the pseudooctahedral complexes, e.g. [P-3-(P(3)fc(2))Ru(NCCH2R)Cl-2] R = H, Ph while the reaction of [(P(3)fc(2))RuCl2] with pyridines results in partial deligation of one of the ferrocenyl phosphine ligand arms to give the products [P-2-(eta (5)-(R2PC5H4)Fe-eta (5):eta (5)-(C5H4P(R')C5H4Fe(eta (5)-C5H4PR2))Ru(pyr)(2)Cl-2]. The latter products revert to the starting complexes in the absence of excess pyridine in solution. The deligated pendant phosphine may be 'trapped' by reaction with Pd(II) or elemental sulfur. A molecular modelling study has been carried out to verify the conformations of the products. The single crystal structures of mer-[P-3-(P(3)fc)(2)Ru(CO)Cl-2], and mer-[P-2-(P(3)fc)(2)Ru(pyr)(2)Cl-2] have been determined. Cyclic voltammetry supports the role assigned to pyridine in the reaction with the P(3)Fc(2)-RuCl2 complexes. (C) 2001 Published by Elsevier Science B.V.

  DOI：

  10.1016/s0022-328x(01)01135-4