| 1266511-89-0

• CAS: 1266511-89-0
• 化学式: C₂₂H₂₂FeN₄
• 分子量: 398.29
• InChiKey: NPGZIMFGLBUBRV-UHFFFAOYSA-N

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

• 作为反应物：
  描述：

  2-二环己膦基-2'-(N,N-二甲胺)-联苯 、 lithium tetrachloropalladate 、 在 CH₃COONa 作用下， 以 甲醇 、 二氯甲烷 为溶剂， 以51%的产率得到
  参考文献：
  名称：

  Synthesis, characterization and crystal structures of monocyclopalladated and biscyclopalladated 1,1′-bisferrocenylpyrimidine–monophosphine complexes

  摘要：

  A new 1,1'-bisferrocenylpyrimidine ligand [{(eta(5)-C5H4)-N2C4H-2CH(3)}(2)Fe] 1 was conveniently prepared via the coupling reaction of 1,1'-dichloromercuriferrocene and 4,6-dimethyl-2-iodopyrimidine, and its monophosphine-palladacycle complexes 2-3 were also readily obtained from the cyclopalladation reactions and bridge-splitting reactions. These compounds have been characterized by H-1 NMR, IR, ESI-MS, and elemental analysis. The complex 2 was found to be a biscyclopalladated complex, while the complex 3 was a monocyclopalladated complex. Additionally, their detailed structures have been determined by X-ray single-crystal diffraction. The most striking common feature of the structures of 2-3 is intermolecular C-H center dot center dot center dot Cl hydrogen bonds, which are attributed to construct the 1D chain structures. (C) 2010 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2010.08.046
• 作为产物：
  描述：

  1,1'-bis(chloromercurio)ferrocene 、 4,6-二甲基-2-碘嘧啶 在 四(三苯基膦)钯 NaI 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 以83%的产率得到
  参考文献：
  名称：

  Synthesis, characterization and crystal structures of monocyclopalladated and biscyclopalladated 1,1′-bisferrocenylpyrimidine–monophosphine complexes

  摘要：

  A new 1,1'-bisferrocenylpyrimidine ligand [{(eta(5)-C5H4)-N2C4H-2CH(3)}(2)Fe] 1 was conveniently prepared via the coupling reaction of 1,1'-dichloromercuriferrocene and 4,6-dimethyl-2-iodopyrimidine, and its monophosphine-palladacycle complexes 2-3 were also readily obtained from the cyclopalladation reactions and bridge-splitting reactions. These compounds have been characterized by H-1 NMR, IR, ESI-MS, and elemental analysis. The complex 2 was found to be a biscyclopalladated complex, while the complex 3 was a monocyclopalladated complex. Additionally, their detailed structures have been determined by X-ray single-crystal diffraction. The most striking common feature of the structures of 2-3 is intermolecular C-H center dot center dot center dot Cl hydrogen bonds, which are attributed to construct the 1D chain structures. (C) 2010 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2010.08.046