bromo[methyl 2-(diphenylphosphino)pyridine-κP](η(3)-methallyl)nickel(II) | 171562-71-3

• 英文名称: bromo[methyl 2-(diphenylphosphino)pyridine-κP](η(3)-methallyl)nickel(II)
• CAS: 171562-71-3
• 化学式: C₂₁H₂₁BrNNiP
• 分子量: 456.972
• InChiKey: IILRFVFNAYIQMY-UHFFFAOYSA-M

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

• 作为反应物：
  描述：

  四氟化硼(+3)铊(+1) 、 bromo[methyl 2-(diphenylphosphino)pyridine-κP](η(3)-methallyl)nickel(II) 以 四氢呋喃 、 二氯甲烷 为溶剂， 以45%的产率得到bis[μ-2-(diphenylphosphino)pyridine-κ(2)P,N]bis(η(3)-methallyl)nickel(II) bis(tetrafluoroborate)*CH2Cl2
  参考文献：
  名称：

  Cationic Methallylnickel Complexes with Chelating Ligands, a New Dynamic Complex Isomerization Equilibrium

  摘要：

  The synthesis of the cationic complexes [methyl 2-(diphenylphosphino)benzoate-kappa(2)P,O](eta(3)-methallyl)nickel(II) tetrafluoroborate (1), [methyl 2-(diphenylphosphino)nicotinate-kappa(2)P,N](eta(3)-methallyl)nickel(II) tetrafluoroborate (2), and bis[mu-2-(diphenylphosphino)pyridine kappa(2)P,N]bis(eta(3)-methallyl)nickel(II) bis(tetrafluoroborate). CH2Cl2 (3) are reported. The crystal structures of 1 and 2 have been disclosed in a preliminary previous paper. The molecular structure of the cation of 2 in the crystal shows that the ligand forms a strained 4-membered ring with a kappa(2)P,N coordination. In solution a new dynamic complex isomerization was found, indicating an equilibrium between 2 and 4, the latter with a 6-membered ring and a kappa(2)P,O coordination of the ligand methyl 2-(diphenylphosphino)nicotinate (5).

  DOI：

  10.1021/om00011a055
• 作为产物：
  描述：

  bis[(η(3)-methallyl)nickel(II) bromide] 、 二苯基-2-吡啶膦 以 四氢呋喃 为溶剂， 以100%的产率得到bromo[methyl 2-(diphenylphosphino)pyridine-κP](η(3)-methallyl)nickel(II)
  参考文献：
  名称：

  Cationic Methallylnickel Complexes with Chelating Ligands, a New Dynamic Complex Isomerization Equilibrium

  摘要：

  The synthesis of the cationic complexes [methyl 2-(diphenylphosphino)benzoate-kappa(2)P,O](eta(3)-methallyl)nickel(II) tetrafluoroborate (1), [methyl 2-(diphenylphosphino)nicotinate-kappa(2)P,N](eta(3)-methallyl)nickel(II) tetrafluoroborate (2), and bis[mu-2-(diphenylphosphino)pyridine kappa(2)P,N]bis(eta(3)-methallyl)nickel(II) bis(tetrafluoroborate). CH2Cl2 (3) are reported. The crystal structures of 1 and 2 have been disclosed in a preliminary previous paper. The molecular structure of the cation of 2 in the crystal shows that the ligand forms a strained 4-membered ring with a kappa(2)P,N coordination. In solution a new dynamic complex isomerization was found, indicating an equilibrium between 2 and 4, the latter with a 6-membered ring and a kappa(2)P,O coordination of the ligand methyl 2-(diphenylphosphino)nicotinate (5).

  DOI：

  10.1021/om00011a055