| 1430074-98-8

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• CAS: 1430074-98-8
• 化学式: C₂₈H₂₄MgN₈O₄S₈
• 分子量: 817.383
• InChiKey: FGMOHJNYHAUYTI-CEDCMUAZSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为反应物：
  描述：

  在 三氟乙酸 作用下， 反应 12.0h， 以45.2%的产率得到tetra(2-hydroxymethyl-1,4-dithiin)porphyrazine
  参考文献：
  名称：

  Photocatalytic properties and electrochemical characteristic of a novel biomimetic oxygenase enzyme photocatalyst iron(II) tetrahydroxymethyl tetra(1,4-dithiin) porphyrazine for the degradation of organic pollutants

  摘要：

  A novel photocatalyst iron(II) tetrahydoxymethyl-tetra(1,4-dithiin) porphyrazine (abbreviated as FePz(hmdtn)(4)) has been successfully synthesized by template method. The prepared FePz(hmdtn)(4)) was further characterized by UV-vis, FT-IR, H-1 NMR, LC-MS, XPS. FePz(hmdtn)(4) supported on an Amberlite CG-400 resin was used as a biomimetic catalyst for the activation of molecular oxygen with visible light to degrade a probe dye compound Rhodamine B (RhB) in aqueous solution with the degradation yield in 79% for 24 h. By means of cyclic voltammetry, the E-HOMO and the Delta EHOMO-LUMO were obtained by comparing the CV and DPV spectra of the metal-free compound with FePz(hmdtn)(4), which indicated the central Fe2+ showed strong electron donating property for activating molecular oxygen to degrade organic pollutants. The electrochemical results were further verified by the quantum chemical DPT calculation. (C) 2013 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.molcata.2013.02.013
• 作为产物：
  描述：

  2,3-dicyano-5-hydroxymethyl-1,4-dithiin 在 碘 、 magnesium 、 正丁醇 作用下， 反应 24.0h， 以71.3%的产率得到
  参考文献：
  名称：

  Photocatalytic properties and electrochemical characteristic of a novel biomimetic oxygenase enzyme photocatalyst iron(II) tetrahydroxymethyl tetra(1,4-dithiin) porphyrazine for the degradation of organic pollutants

  摘要：

  A novel photocatalyst iron(II) tetrahydoxymethyl-tetra(1,4-dithiin) porphyrazine (abbreviated as FePz(hmdtn)(4)) has been successfully synthesized by template method. The prepared FePz(hmdtn)(4)) was further characterized by UV-vis, FT-IR, H-1 NMR, LC-MS, XPS. FePz(hmdtn)(4) supported on an Amberlite CG-400 resin was used as a biomimetic catalyst for the activation of molecular oxygen with visible light to degrade a probe dye compound Rhodamine B (RhB) in aqueous solution with the degradation yield in 79% for 24 h. By means of cyclic voltammetry, the E-HOMO and the Delta EHOMO-LUMO were obtained by comparing the CV and DPV spectra of the metal-free compound with FePz(hmdtn)(4), which indicated the central Fe2+ showed strong electron donating property for activating molecular oxygen to degrade organic pollutants. The electrochemical results were further verified by the quantum chemical DPT calculation. (C) 2013 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.molcata.2013.02.013