[Au(Ph)(1-methyl-1-azonia-3,5-diaza-7-phosphaadamantane)][BPh4] | 168066-17-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪烷类
• 英文名称: [Au(Ph)(1-methyl-1-azonia-3,5-diaza-7-phosphaadamantane)][BPh4]
• 英文别名: Benzene;gold(1+);1-methyl-3,5-diaza-1-azonia-7-phosphatricyclo[3.3.1.13,7]decane;tetraphenylboranuide
• CAS: 168066-17-9
• 化学式: C₁₃H₂₀AuN₃P*C₂₄H₂₀B
• 分子量: 765.496
• InChiKey: DUZXXSYJKABRNR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.85
• 重原子数：
  43
• 可旋转键数：
  4
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.19
• 拓扑面积：
  6.5
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  [AuI(1-methyl-1-azonia-3,5-diaza-7-phosphaadamantane)3]I3 、 四苯硼钠 以 水 为溶剂， 以69%的产率得到[Au(Ph)(1-methyl-1-azonia-3,5-diaza-7-phosphaadamantane)][BPh4]
  参考文献：
  名称：

  Synthesis and Structural Characterization of the Luminescent Gold(I) Complex [(MeTPA)3AuI]I3. Use of NaBPh4 as a Phenyl-Transfer Reagent To Form [(MeTPA)AuPh](BPh4) and (TPA)AuPh

  摘要：

  The luminescent gold(I) complex [(MeTPA)(3)AuI]I-3 . 2H(2)O (1) has been synthesized and structurally characterized, where [MeTPA]I is 1-methyl-1-azonia-3,5-diaza-7-phosphaadamantane iodide. This complex shows an interesting temperature-dependent emission spectrum in the solid state. It gives a yellow emission (598 nm) at 77 K and an orange emission (686 nm) at 140 K. Compound 1 is soluble in water and undergoes an unusual phenyl-transfer reaction in aqueous solution with NaBPh(4) to form [(MeTPA)AuPh](BPh(4)) (2). The closely related complex [(TPA)(3)Au] Cl, containing the 1,3,5-triaza-7-phosphaadamantane ligand (TPA), also undergoes a similar reaction with NaBPh(4) to form (TPA)AuPh (3). Compounds 2 and 3 both have been crystallographically characterized.

  DOI：

  10.1021/om00009a022