iron(II) 2,3-tetrapyridinoporphyrazine | 14526-34-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 菲咯啉
• 英文名称: iron(II) 2,3-tetrapyridinoporphyrazine
• 英文别名: iron(II) tetrapyridinoporphyrazine；FeTAP；Fe tetrapyridinoporphyrazine；Fe(tetra-2,3-pyridinoporphyrazine)；2,5,11,14,20,23,29,32,37,39-Decaza-38,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13(18),14,16,19(39),20,22(27),23,25,28,30(37),31(36),32,34-nonadecaene;iron(2+)
• CAS: 14526-34-2
• 化学式: C₂₈H₁₂FeN₁₂
• 分子量: 572.331
• InChiKey: BPRJTRCGOBOGEB-UHFFFAOYSA-N

物化性质

• 熔点：
  >300 °C

计算性质

• 辛醇/水分配系数(LogP)：
  3.7
• 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：
  128
• 氢给体数：
  0
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  iron(II) 2,3-tetrapyridinoporphyrazine 在 氯化亚砜 、 lithium tetrachloroaluminate 作用下， 生成 FeTAP*SOCl2
  参考文献：
  名称：

  Effect of N atoms in the backbone of metal phthalocyanine derivatives on their catalytic activity to lithium battery

  摘要：

  Metal phthalocyanine (MPc, M = Mn2+, Fe2+, Co2+, Ni2+ and Cu2+). metal tetrapyridinoporphyrazine, and metal tetrapyrazinoporphyrazine are synthesized by microwave reaction and characterized by elemental analyzer, IR spectroscopy and UV-vis spectroscopy. The catalytic activity of MPc derivatives to Li/SOCl2 battery is evaluated by the relative discharge energy of the battery whose electrolyte contains the compounds. The discharge energy of Li/SOCl2 battery catalyzed by MPc is approximately 0-61% higher than that of Li/SOCl2 battery in the absence of compounds, depending on the central metal ion. To the same central metal ion, the discharge energy of Li/SOCl2 battery catalyzed by MTAP is approximately 60% higher than that by MPc. The discharge energy of Li/SOCl2 battery in which SOCl2 contains MPTpz is approximately 17-19% higher than that of the battery in the absence Of compounds, and almost independent of central metal ions. It shows a correlation existing between the Structure and the catalytic active sites of MPc derivatives. The double active site model is proposed to interpret the results. (C) 2009 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.molcata.2009.11.014
• 作为产物：
  描述：

  尿素 、 铁粉 、 2,3-吡啶二甲酸 在 (NH₄)2Mo₂O₇ 作用下， 以 neat (no solvent) 为溶剂， 以55%的产率得到iron(II) 2,3-tetrapyridinoporphyrazine
  参考文献：
  名称：

  Effect of N atoms in the backbone of metal phthalocyanine derivatives on their catalytic activity to lithium battery

  摘要：

  Metal phthalocyanine (MPc, M = Mn2+, Fe2+, Co2+, Ni2+ and Cu2+). metal tetrapyridinoporphyrazine, and metal tetrapyrazinoporphyrazine are synthesized by microwave reaction and characterized by elemental analyzer, IR spectroscopy and UV-vis spectroscopy. The catalytic activity of MPc derivatives to Li/SOCl2 battery is evaluated by the relative discharge energy of the battery whose electrolyte contains the compounds. The discharge energy of Li/SOCl2 battery catalyzed by MPc is approximately 0-61% higher than that of Li/SOCl2 battery in the absence of compounds, depending on the central metal ion. To the same central metal ion, the discharge energy of Li/SOCl2 battery catalyzed by MTAP is approximately 60% higher than that by MPc. The discharge energy of Li/SOCl2 battery in which SOCl2 contains MPTpz is approximately 17-19% higher than that of the battery in the absence Of compounds, and almost independent of central metal ions. It shows a correlation existing between the Structure and the catalytic active sites of MPc derivatives. The double active site model is proposed to interpret the results. (C) 2009 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.molcata.2009.11.014
• 作为试剂：
  描述：

  滴滴涕 在 iron(II) 2,3-tetrapyridinoporphyrazine 作用下， 以 吡啶 为溶剂， 反应 3.0h， 以29.2%的产率得到1,1-双(P-氯苯基)-2-氯乙烯
  参考文献：
  名称：

  铁（II）酞菁、2,3-和3,4-四吡啶并卟啉配合物的滴滴涕还原脱氯的合成、电化学、光谱电化学和催化性能

  摘要：

  合成铁 (II) 2,3-和 3,4-四吡啶并卟啉配合物（2,3-PyD 和 3,4-PyD），并对其电化学、紫外-可见光谱电化学和对 1 还原脱氯的催化性能进行了表征吡啶、二甲基亚砜 (DMSO)、N,N'-二甲基乙酰胺 (DMA) 和 N,N'-二甲基甲酰胺中的 ,1-双(4-氯苯基)-2,2,2-三氯乙烷 (p,p'-DDT) (DMF)。这些特性与未取代的铁 (II) 酞菁 ((Pc) Fe ) 的特性进行了比较。电化学表明在三种研究的衍生物中最多有三种还原和一种氧化。在所有研究的溶剂中，最简单的还原发生在 3,4-PyD，而最困难的还原发生在 (Pc) Fe。第一次还原是以金属为中心的，对应于 [P(-2)Fe(I)] 的形成-而第二次和第三次还原是以环为中心的，逐步生成 [P(-3)Fe(I)]2-· 和 [P(-4)Fe(I)]3-, 其中 P = 酞菁或四吡啶并卟啉环。所有

  DOI：

  10.1142/s1088424613500077