| 1206692-23-0

• CAS: 1206692-23-0
• 化学式: C₁₃H₁₁AuCl₂N₂S
• 分子量: 495.182
• InChiKey: YPEPVRULOUXUCC-UHFFFAOYSA-K

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：

  N-(4-methylphenyl)pyridine-2-thiocarboxamide 、 四氯金酸水合物 以 水 为溶剂， 以88%的产率得到
  参考文献：
  名称：

  The cycloauration of pyridine-2-thiocarboxamide ligands

  摘要：

  Reactions of H[AuCl4] with N-substituted 2-pyridine thiocarboxamide ligands 2-(C5H4N)C(S)NHR (R = p-C6H4Me, CH2Ph, Me, p-C6H4OMe) gave cycloaurated derivatives {(C5H4N)C(S)NR}AuCl2, with the ligand bonded as the thiol tautomer through the deprotonated SH group and the pyridine N atom to give a five-membered metallacyclic ring. The X-ray structure determination of the R = CH2Ph derivative shows a square-planar gold(III) complex that dimerises in the solid state by weak Au center dot center dot center dot S intermolecular interactions. In contrast, in the reaction of H[AuCl4] with 2-(C5H4N)C(S)NHR where R = 2-pyridyl, the ligand was oxidised to give a 1,2,4-thiadiazolo[2,3-a] pyridinium heterocyclic ring that was crystallographically characterised. (C) 2009 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2009.10.003