lithium phthalocyanine radical | 103088-30-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 异吲哚及其衍生物
• 英文名称: lithium phthalocyanine radical
• 英文别名: lithium monophthalocyanine；lithium phthalocyanine
• CAS: 103088-30-8
• 化学式: C₃₂H₁₆N₈*Li
• 分子量: 519.474
• InChiKey: MTWPDVACPUGGIK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  41
• 可旋转键数：
  0
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  87.5
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  lithium phthalocyanine radical 在 对苯二酚 作用下， 150.0 ℃ 、1.33 Pa 条件下， 反应 2.0h， 以70%的产率得到酞青
  参考文献：
  名称：

  Reactions of lithium phthalocyanine with various oxidizing agents

  摘要：

  DOI：

  10.1007/bf00953012
• 作为产物：
  描述：

  1,2-二氰基苯 在 lithium 作用下， 生成 lithium phthalocyanine radical
  参考文献：
  名称：

  Charge transport in lithium phthalocyanine

  摘要：

  The ac electrical properties of monoclinic lithium phthalocyanine (LiPc) and of the iodinated compound LiPcI have been investigated in the frequency and temperature regimes 20 Hz≤ν≤1 GHz and 1.5 K≤T≤300 K, respectively. Both compounds are semiconductors with dielectric constants ε∞≊6 (LiPc) and 20 (LiPcI). Up to room temperature tunneling of charge carriers is the dominant conduction process in both compounds, yielding intrinsic dc conductivities σdc≊5.3×10−4 Ω−1 cm−1 (LiPc) and 0.2 Ω−1 cm−1 (LiPcI). The frequency and temperature dependence of the complex ac conductivity suggests polarons as the dominant species of charge carriers. The higher conductivity of the iodinated compound can be attributed to an enhanced mobility of the polaronic charge carriers which is most probably due to a better overlap of the π orbitals along the stacking direction of the molecules.

  DOI：

  10.1063/1.471134

文献信息

• Reactions of lithium phthalocyanine with various oxidizing agents
  作者：V. B. Zhukhovitskii、N. N. Ezhova、V. I. Krinichnyi、Ya. A. Letuchii、A. M. Ton'shin、K. M. Dyumaev、M. L. Khidekel'

  DOI：10.1007/bf00953012

  日期：1985.12
• Charge transport in lithium phthalocyanine
  作者：M. Dumm、P. Lunkenheimer、A. Loidl、B. Assmann、H. Homborg、P. Fulde

  DOI：10.1063/1.471134

  日期：1996.4

  The ac electrical properties of monoclinic lithium phthalocyanine (LiPc) and of the iodinated compound LiPcI have been investigated in the frequency and temperature regimes 20 Hz≤ν≤1 GHz and 1.5 K≤T≤300 K, respectively. Both compounds are semiconductors with dielectric constants ε∞≊6 (LiPc) and 20 (LiPcI). Up to room temperature tunneling of charge carriers is the dominant conduction process in both compounds, yielding intrinsic dc conductivities σdc≊5.3×10−4 Ω−1 cm−1 (LiPc) and 0.2 Ω−1 cm−1 (LiPcI). The frequency and temperature dependence of the complex ac conductivity suggests polarons as the dominant species of charge carriers. The higher conductivity of the iodinated compound can be attributed to an enhanced mobility of the polaronic charge carriers which is most probably due to a better overlap of the π orbitals along the stacking direction of the molecules.