| 1265355-27-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• CAS: 1265355-27-8
• 化学式: C₂₄H₃₆N₄O₂S₄Si₂
• 分子量: 597.01
• InChiKey: HJHXACPTMIVOKN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.09
• 重原子数：
  36.0
• 可旋转键数：
  12.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  54.1
• 氢给体数：
  0.0
• 氢受体数：
  10.0

反应信息

• 作为反应物：
  描述：

  在 四丁基氟化铵 作用下， 以 四氢呋喃 为溶剂， 生成 、
  参考文献：
  名称：

  Synthesis, crystal structure, and charge-transfer complexes of TTF derivatives having two imidazole hydrogen-bonding units

  摘要：

  New hydrogen-bond functionalized tetrathiafulvalene (TTF) derivatives (1 and 2) having two imidazole moieties which are attached to TTF at the 2- and 4-positions in the imidazole ring respectively were synthesized Electrochemical measurements indicated that the introduction of imidazole moieties at 2- or 4-positions slightly reduced or enhanced the electron-donating ability of TTF In the crystal structure of 1 N-H N hydrogen-bonds of the imidazole ring formed a two-dimensional sheet and further pi-stacks on the TTF skeleton built up a one-dimensional column Mixing 1 with electron-acceptors afforded fully ionic charge-transfer complexes having a 1 1 donor-acceptor ratio while complex formation of 2 with tetracyanoquinodimethane and p-chloranil yielded partial charge-transfer complexes showing semiconducting behaviors (room temperature conductivities=10(-3)-10(-2) S cm(-1)) (C) 2009 Elsevier B V All rights reserved

  DOI：

  10.1016/j.physb.2009.10.022
• 作为产物：
  描述：

  bis(n-buthylstannyl)tetrathiafulvalene 、 2-iodo-1-((2-(trimethylsilyl)ethoxy)methyl)-1H-imidazole 在 copper(l) iodide 、 四(三苯基膦)钯 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 以11%的产率得到
  参考文献：
  名称：

  Synthesis, crystal structure, and charge-transfer complexes of TTF derivatives having two imidazole hydrogen-bonding units

  摘要：

  New hydrogen-bond functionalized tetrathiafulvalene (TTF) derivatives (1 and 2) having two imidazole moieties which are attached to TTF at the 2- and 4-positions in the imidazole ring respectively were synthesized Electrochemical measurements indicated that the introduction of imidazole moieties at 2- or 4-positions slightly reduced or enhanced the electron-donating ability of TTF In the crystal structure of 1 N-H N hydrogen-bonds of the imidazole ring formed a two-dimensional sheet and further pi-stacks on the TTF skeleton built up a one-dimensional column Mixing 1 with electron-acceptors afforded fully ionic charge-transfer complexes having a 1 1 donor-acceptor ratio while complex formation of 2 with tetracyanoquinodimethane and p-chloranil yielded partial charge-transfer complexes showing semiconducting behaviors (room temperature conductivities=10(-3)-10(-2) S cm(-1)) (C) 2009 Elsevier B V All rights reserved

  DOI：

  10.1016/j.physb.2009.10.022