Re(NPh)Cl(P-O)2 | 278608-43-8

• 英文名称: Re(NPh)Cl(P-O)2
• CAS: 278608-43-8
• 化学式: C₄₆H₄₁ClNO₂P₂Re
• 分子量: 923.445
• InChiKey: OQPREWBCFOKMOM-UHFFFAOYSA-K

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：
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• 氢给体数：
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• 氢受体数：
  None

反应信息

• 作为产物：
  描述：

  trichloro(phenylimido)bis(triphenylphosphine)rhenium(V) 、 2-(diphenylphosphinomethyl)-4-methylphenol 在 N(C₂H₅)3 作用下， 以 乙醇 为溶剂， 以65%的产率得到Re(NPh)Cl(P-O)2
  参考文献：
  名称：

  Bidentate phosphinophenol R2POH ligands. Oxo and imido Re(V) complexes of 2-diphenylphosphinomethyl-4-methylphenol (POH). Crystal structure of ReOCl(PO)2

  摘要：

  The PPh3 ligands were displaced and ReOCl3(P-OH)(2) (1) was formed when ReOCl3(PPh3)(2) and 2 equiv. of the title ligand (P-OH) were refluxed in acetonitrile. In the presence of the proton quencher NEt3, ligand deprotonation took place and the bis-chelate complex ReOCl(P-O)(2) (2) was isolated. Under similar conditions, ReO(OEt)(P-O)(2) (3) was obtained from ReO(OEt)Cl-2(PPh3)(2). NMR data are consistent with the tPans-O-Re-O-cis-P,P 'twisted' octahedral geometry for these species. The corresponding phenylimido complex Re(NPh)Cl(P-O)(2) (4), similarly prepared from Re(NPh)Cl-3(PPh3)(2), adopts the trans-O-Re-NPh-trans-P,P arrangement. The structure of 2 was confirmed by X-ray diffraction. The methylene group in the side-arm imparts flexibility to the chelate ring and allows the bond angles to be closer to the ideal octahedral values than in the corresponding diphenylphosphinophenolato compound. The six-membered rings adopt a flattened boat conformation bringing the phenolate unit out of the coordination plane and making the overall van der Waals envelope substantially different from that of the diphenylphosphinophenol-based complex. (C) 2000 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0020-1693(00)00066-9