[AuCCC6H3(Me-2)NH2-4]n | 850567-01-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: [AuCCC6H3(Me-2)NH2-4]n
• CAS: 850567-01-0
• 化学式: C₉H₈AuN
• 分子量: 327.136
• InChiKey: VORKDLMQLCFATB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.43
• 重原子数：
  11.0
• 可旋转键数：
  0.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  26.02
• 氢给体数：
  1.0
• 氢受体数：
  1.0

反应信息

• 作为反应物：
  描述：

  [AuCCC6H3(Me-2)NH2-4]n 、 2-异氰基-1,3,5-三甲基苯 以 二氯甲烷 为溶剂， 以55%的产率得到[Au(CCC6H3(Me-2)NH2-4)(XylNC)]
  参考文献：
  名称：

  Gold(I) alkynyl complexes derived from ethynylanilines: crystal structure of [Au(CC-4-C6H4NH2){P(3-tolyl)3}] a polymer in the solid state via NH⋯Au contacts

  摘要：

  Reaction of [AuCl(SMe2)] with para-ethynylaniline and para-ethynyl-ortho-toluidine affords oligomers, [Au(C equivalent to C-4-C6H3RNH2)L] (R = H, Me), which in turn react with tertiary phosphines or 2,5-dimethylphenylisocyanide to give monomeric adducts, [Au(C equivalent to C-4-C6H3RNH2)L]. One of these, [Au(C equivalent to C-4-C6H4NH2){P(3-tolyl)(3)}], has been crystallographically characterised and is a polymer in the solid state, being held together via (NHAu)-Au-. . . contacts. (c) 2004 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2004.06.068
• 作为产物：
  描述：

  氯(二甲基硫化)金(I) 、 4-乙炔基-2-甲基苯胺 在 triethylamine 作用下， 以 二氯甲烷 为溶剂， 以72%的产率得到[AuCCC6H3(Me-2)NH2-4]n
  参考文献：
  名称：

  Gold(I) alkynyl complexes derived from ethynylanilines: crystal structure of [Au(CC-4-C6H4NH2){P(3-tolyl)3}] a polymer in the solid state via NH⋯Au contacts

  摘要：

  Reaction of [AuCl(SMe2)] with para-ethynylaniline and para-ethynyl-ortho-toluidine affords oligomers, [Au(C equivalent to C-4-C6H3RNH2)L] (R = H, Me), which in turn react with tertiary phosphines or 2,5-dimethylphenylisocyanide to give monomeric adducts, [Au(C equivalent to C-4-C6H3RNH2)L]. One of these, [Au(C equivalent to C-4-C6H4NH2){P(3-tolyl)(3)}], has been crystallographically characterised and is a polymer in the solid state, being held together via (NHAu)-Au-. . . contacts. (c) 2004 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2004.06.068