| 144839-46-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 亚胺内酰胺
• CAS: 144839-46-3
• 化学式: C₆H₁₂AgN₂S*NO₃
• 分子量: 314.114
• InChiKey: KNGQKYRTFLAEEQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.34
• 重原子数：
  14.0
• 可旋转键数：
  1.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  81.47
• 氢给体数：
  1.0
• 氢受体数：
  3.0

反应信息

• 作为产物：
  描述：

  silver nitrate 、 N-(n-propyl)imidazolidine-2-thione 以 甲醇 、 乙腈 为溶剂， 生成
  参考文献：
  名称：

  Synthesis of silver(I) complexes of thiones and their characterization by 13C, 15N and 107Ag NMR spectroscopy

  摘要：

  Silver(I) complexes of thiones (L), [LAgNO3] and [AgL2]NO3 have been prepared and characterized by elemental analysis, IR and NMR (H-1, C-13, N-15 and Ag-107) spectroscopy. An upfield shift in the C=S resonance of thiones in C-13 NMR and downfield shifts in N-H resonances in H-1 and N-15 NMR are consistent with the sulfur coordination to silver(1). In Ag-107 NMR, the AgNO3 signal is deshielded by 300-500 ppm on its coordination to thiones. Greater upfield shifts in C-13 NMR are observed for [LAgNO3] compared with [AgL2]NO3 complexes, whereas the opposite trend is observed for H-1, N-15 and Ag-107 chemical shifts. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0277-5387(02)00981-6