| 1373824-58-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• CAS: 1373824-58-8
• 化学式: C₁₀H₉AgO
• 分子量: 253.049
• InChiKey: PPDNRMVHDQGYPK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.71
• 重原子数：
  12.0
• 可旋转键数：
  3.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  9.23
• 氢给体数：
  0.0
• 氢受体数：
  1.0

反应信息

• 作为反应物：
  描述：

  、 水 、 silver trifluoroacetate 以 水 为溶剂， 以45%的产率得到
  参考文献：
  名称：

  Diverse intermolecular interactions in silver(I)-organic frameworks constructed with flexible supramolecular synthons

  摘要：

  Three ligands bearing terminal ethynide moiety attached via pendent arm to a phenyl skeleton have been used in synthesis of three silver (I) complexes, namely, [(AgL1)(AgCF3CO2)(3)](n) (1), {[(AgL2)(AgCF3-CO2) (6)(H2O)(2)]center dot(H2O)(6)}(n) (2) and [(AgL3)center dot(AgCF3CO2)(5)(H2O)](n) (3), in which several unconventional intermolecular interactions (silver-ethynyl, silverearomatic, argentophilicity and C-H center dot center dot center dot pi) have been shown to play vital role in the formation and stabilization of supramolecular structures. In 1, butterfly-shaped Ag-4 baskets are interconnected together by trifluoroacetate groups to lead to a layer structure, which is also consolidated by silverearomatic interactions, adjacent layers are then linked into a three-dimensional supramolecular architecture through weak C-H center dot center dot center dot F hydrogen bonding. In 2, ladder type chains are associated into three-dimensional supramolecular architecture through a rich hydrogen-bonding system. In 3, square-pyramidal Ag-5 baskets are also fused together by the trifluoroacetate groups with the assistance of argentophilic interactions and silverearomatic interaction give rise to a 2D coordination network, which are further united by C-H center dot center dot center dot pi interaction to produce a three-dimensional supramolecular framework. (C) 2012 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jorganchem.2012.02.029
• 作为产物：
  描述：

  苄基丙炔基醚 、 silver nitrate 在 triethylamine 作用下， 以 乙腈 为溶剂， 以80%的产率得到
  参考文献：
  名称：

  Diverse intermolecular interactions in silver(I)-organic frameworks constructed with flexible supramolecular synthons

  摘要：

  Three ligands bearing terminal ethynide moiety attached via pendent arm to a phenyl skeleton have been used in synthesis of three silver (I) complexes, namely, [(AgL1)(AgCF3CO2)(3)](n) (1), {[(AgL2)(AgCF3-CO2) (6)(H2O)(2)]center dot(H2O)(6)}(n) (2) and [(AgL3)center dot(AgCF3CO2)(5)(H2O)](n) (3), in which several unconventional intermolecular interactions (silver-ethynyl, silverearomatic, argentophilicity and C-H center dot center dot center dot pi) have been shown to play vital role in the formation and stabilization of supramolecular structures. In 1, butterfly-shaped Ag-4 baskets are interconnected together by trifluoroacetate groups to lead to a layer structure, which is also consolidated by silverearomatic interactions, adjacent layers are then linked into a three-dimensional supramolecular architecture through weak C-H center dot center dot center dot F hydrogen bonding. In 2, ladder type chains are associated into three-dimensional supramolecular architecture through a rich hydrogen-bonding system. In 3, square-pyramidal Ag-5 baskets are also fused together by the trifluoroacetate groups with the assistance of argentophilic interactions and silverearomatic interaction give rise to a 2D coordination network, which are further united by C-H center dot center dot center dot pi interaction to produce a three-dimensional supramolecular framework. (C) 2012 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jorganchem.2012.02.029