[(4-hydroxy-2-mercapto-6-methylpyrimidine(-2H))(Sn(PhCH2)3)2] | 888230-71-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: [(4-hydroxy-2-mercapto-6-methylpyrimidine(-2H))(Sn(PhCH2)3)2]
• CAS: 888230-71-5
• 化学式: C₄₇H₄₆N₂OSSn₂
• 分子量: 924.381
• InChiKey: KGRNTUOLMHMVPR-UHFFFAOYSA-L

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：

  三苄基氯化锡 、 甲基硫脲嘧啶 在 sodium ethoxide 作用下， 以 甲醇 为溶剂， 以76%的产率得到[(4-hydroxy-2-mercapto-6-methylpyrimidine(-2H))(Sn(PhCH2)3)2]
  参考文献：
  名称：

  New triorganotin(IV) complexes of polyfunctional S,N,O-ligands: Supramolecular structures based on π⋯π and/or C–H⋯π interactions

  摘要：

  A series of new triorganotin(IV) complexes with 4-hydroxy-2-mercapto-6-methylpyrimidine ((LH2)-H-1), 4-hydroxy-2-mercapto-pyrimidine ((LH2)-H-2), 2,4(1H,3H)-pyrimidinedithione ((LH2)-H-3) (Scheme 1) of the type R3SnLSnR3 (R = Me 1, 4, 7; R = Ph 2, 5, 8; R = PhCH2 3, 6, 9) have been synthesized by reactions of triorganotin(IV) chloride and corresponding ligands. All complexes are characterized by elemental analyses, IR spectra and NMR spectra analyses. Among them, complexes 2, 5 and 8 are also characterized by X-ray crystallography diffraction analyses. Significant pi center dot center dot center dot pi stacking, C-H center dot center dot center dot pi interactions and intramolecular hydrogen bonds stabilize these structures. (c) 2006 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jorganchem.2005.12.054