| 1219834-06-6

• CAS: 1219834-06-6
• 化学式: C₈₀H₇₈CuN₁₀O₁₂*F₆P
• 分子量: 1580.07
• InChiKey: UPQDLQCRTGKWDB-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：

  在 ammonium hydroxide 作用下， 以 水 、 乙腈 为溶剂， 反应 1.0h， 以88%的产率得到
  参考文献：
  名称：

  Cu(I)-菲咯啉类链烷烃和轮烷的替代脱金属方法

  摘要：

  已经开发了一种新的、危险性较低的方法，用于使用 NH 4 OH水溶液而不是有毒的 KCN对基于 Cu(I)-菲咯啉的互锁分子进行脱金属。这些条件与含有亲核试剂敏感的附加基团（例如 C 60）和配位部分（例如锌 (II)-卟啉）的材料兼容。

  DOI：

  10.1021/ol200304d
• 作为产物：
  描述：

  tetrakis(actonitrile)copper(I) hexafluorophosphate 、 diazidophenanthroline 、 1,3-二乙炔苯 、 6,9,12,15,18,21-Hexaoxa-35,38-diazahexacyclo[24.8.4.22,5.222,25.029,37.032,36]dotetraconta-1(35),2(42),3,5(41),22(40),23,25(39),26(38),27,29(37),30,32(36),33-tridecaene 在 sodium ascorbate 、 CuI 、 DBU 作用下， 以 乙醇 、 水 为溶剂， 以70%的产率得到
  参考文献：
  名称：

  [2]Catenanes Decorated with Porphyrin and [60]Fullerene Groups: Design, Convergent Synthesis, and Photoinduced Processes

  摘要：

  A new class of [2]catenanes containing zinc(II)-porphyrin (ZnP) and/or [60]fullerene (C-60) as appended groups has been prepared. A complete description of the convergent synthetic approach based on Cu(I) template methodology and "click" 1,3-dipolar cycloaddition chemistry is described. This new electron donor-acceptor catenane family has been subjected to extensive spectroscopic, computational, electrochemical and photophysical studies. H-1 NMR spectroscopy and computational analysis have revealed that the ZnP-C-60-[2]catenane adopts an extended conformation with the chromophores as far as possible from each other. A detailed photophysical investigation has revealed that upon irradiation the ZnP singlet excited state initially transfers energy to the (phenanthroline)(2)-Cu(I) complex core, producing a metal-to-ligand charge transfer (MLCT) excited state, which in turn transfers an electron to the C-60 group, generating the ZnP-[Cu(phen)(2)](2+)-C-60(center dot-) charge-separated state. A further charge shift from the (Cu(phen)(2)](2+) complex to the ZnP subunit, competitive with decay to the ground state, leads to the isoenergetic long distance ZnP center dot+-[Cu(phen)(2)](+)-C-60(center dot-) charge-separated radical pair state, which slowly decays back to the ground state on the microsecond time scale. The slow rate of back-electron transfer indicates that in this interlocked system, as in previously studied covalently linked ZnP-C-60 hybrid materials, this process occurs in the Marcus-inverted region.

  DOI：

  10.1021/ja910149f