(μ-2,11-dithia[3.3]paracyclophane-κ2S:S')bis[(6-carboxypyridine-2-carboxylato-κ2N,O6)silver(I)] | 854227-79-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 四氢异喹啉
• 英文名称: (μ-2,11-dithia[3.3]paracyclophane-κ2S:S')bis[(6-carboxypyridine-2-carboxylato-κ2N,O6)silver(I)]
• 英文别名: disilver;6-carboxypyridine-2-carboxylate;3,10-dithiatricyclo[10.2.2.25,8]octadeca-1(15),5,7,12(16),13,17-hexaene
• CAS: 854227-79-5
• 化学式: C₃₀H₂₄Ag₂N₂O₈S₂
• 分子量: 820.398
• InChiKey: NCNVMMIKVSRJHV-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  3.15
• 重原子数：
  44
• 可旋转键数：
  2
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.13
• 拓扑面积：
  231
• 氢给体数：
  2
• 氢受体数：
  12

反应信息

• 作为产物：
  描述：

  吡啶-2,6-二甲酸 、 2,11-二硫杂[3.3]对环芬 、 silver trifluoroacetate 以 甲醇 、 N,N-二甲基甲酰胺 、 均三甲苯 为溶剂， 以68%的产率得到(μ-2,11-dithia[3.3]paracyclophane-κ2S:S')bis[(6-carboxypyridine-2-carboxylato-κ2N,O6)silver(I)]
  参考文献：
  名称：

  (μ-2,11-Dithia[3.3]paracyclophane-κ²S:S′)bis[(6-carboxypyridine-2-carboxylato-κ²N,O⁶)silver(I)]: a mixed-ligand silver-based dinuclear compound

  摘要：

  In the title complex, [Ag-2(C7H4NO4)(2)(C16H16S2)], each Ag-I atom is trigonally coordinated by one S atom of a 2,11-dithia[3.3] paracyclophane (dtpcp) ligand, and by one N and one O atom of a 6-carboxypyridine-2-carboxylate ligand. Dtpcp acts as a bidentate ligand, bridging two inversion-related Ag-I atoms to give a dinuclear silver(I) compound. The dinuclear moieties are interconnected via O-H center dot center dot center dot O hydrogen bonds to form a two-dimensional zigzag sheet. Two such sheets are interwoven via pi-pi interactions between pyridine rings, affording an interwoven bilayer network.

  DOI：

  10.1107/s0108270105006372