[Sn5Ph7(μ3-diisopropylphenylphosphate(2-))(μ-diisopropylphenylphosphate(1-))(μ3-O)(μ-OEt)(EtOH)(H2O)Cl]*H2O | 1034023-97-6

• 英文名称: [Sn5Ph7(μ3-diisopropylphenylphosphate(2-))(μ-diisopropylphenylphosphate(1-))(μ3-O)(μ-OEt)(EtOH)(H2O)Cl]*H2O
• CAS: 1034023-97-6
• 化学式: C₁₀₆H₁₃₄ClO₂₄P₅Sn₅*H₂O
• 分子量: 2594.1
• InChiKey: NOGKVPXMKCUAGF-UHFFFAOYSA-D

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为产物：
  描述：

  乙醇 、 2,6-diisopropylphenyl phosphate 、 二苯基二氯化锡 以 乙醇 为溶剂， 以60%的产率得到[Sn5Ph7(μ3-diisopropylphenylphosphate(2-))(μ-diisopropylphenylphosphate(1-))(μ3-O)(μ-OEt)(EtOH)(H2O)Cl]*H2O
  参考文献：
  名称：

  Asymmetric Pentameric and Tetrameric Organooxotin Clusters: Insights into Their Formation through Partial Dearylation

  摘要：

  The reaction between diphenyltin dichloride and 2,6-diisopropylphenylphosphate (dippH(2)) in ethanol affords a highly asymmetric pentameric organotin cluster, [Sn5Ph7(mu(3)-dipp)(4)(mu-dippH)(mu(3)-O)(mu-OEt)(EtOH)(H2O)Cl] center dot H2O (1), that contains Ph-, EtO-, Cl-, O-2(-), ROPO32-, ROPO3H-, OH2, and EtOH ligands. The same reaction when carried out in iPrOH, under otherwise identical conditions, results in the formation of another pentamer, [Sn5Ph7(mu(3)-dipp)(4)(mu-dippH)(mu(3)-O)(mu-OH)(iPrOH)(H2O)Cl] center dot iPrOH (2). Change of the phosphate ligand to sterically less bulky 2,6-dimethylphenylphosphate in the above reaction carried out in ethanol results in the formation of a tetrameric cluster, [Sn4Ph5(mu(3)-dmpp)(2)(mu-dmpp)(mu-dmppH)(2)(mu(3)-O)(mu-OEt)(EtOH)] center dot EtOH (3). Isolation of 3 provides useful insights into the formation of the pentamers 1 and 2. Compounds 1-3 have been characterized by means of their analytical data, IR, and multinuclear NMR (H-1, P-31, and Sn-119) spectral data. The solid-state structures of 1-3 have been determined by X-ray diffraction studies.

  DOI：

  10.1021/om800162s