zinc(II) complex with monophenyltetrabenzoporphine | 120389-73-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯氮卓类
• 英文名称: zinc(II) complex with monophenyltetrabenzoporphine
• 英文别名: (meso-monophenyltetrabenzoporphinato)zinc(II)；Zn-5-monophenyl-tetrabenzoporphyrin；meso-phenyltetrabenzoporphyrin zinc
• CAS: 120389-73-3
• 化学式: C₄₂H₂₄N₄Zn
• 分子量: 650.069
• InChiKey: ZENLCGKEFIVLRR-YMTASMNGSA-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：
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• 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：

  氢气 、 zinc(II) complex with monophenyltetrabenzoporphine 以 硫酸 、 溶剂黄146 为溶剂， 生成 5-phenyl-tetrabenzoporphyrin
  参考文献：
  名称：

  摘要：

  Kinetic stability of zinc complexes with meso-phenyltetrabenzoporphyrins in DMSO-HOAc mixture and in glacial acetic acid was studied. The stability of complexes was found to decrease with reduction in their macrocyclic effect and with increasing polarization of their macrocycles. The stability of nonplanar and nonsymmetrically substituted complexes was determined to be lower than that of the more planar and symmetrically substituted complexes.

  DOI：

  10.1023/a:1025150018834
• 作为产物：
  描述：

  zinc diacetate 、 5-phenyl-tetrabenzoporphyrin 以 吡啶 为溶剂， 生成 zinc(II) complex with monophenyltetrabenzoporphine
  参考文献：
  名称：

  Complex Formation and Spectral Properties of meso-Phenyltetrabenzoporphyrins in Pyridine and N,N-Dimethylformamide

  摘要：

  Contributions of structural (macroring distortion) and polarization (in asymmetrically substituted derivatives) effects into the reactivity and chromophoric properties of substituted porphyrins were revealed on the basis of the kinetics of complex formation of nona, deca-, undeca-, and dodecasubstituted porphyrins (meso-phenyltetrabenzoporphyrins) with Zn(OAc)(2) in pyridine and the electronic absorption spectra of the ligands and their complexes with Zn(II) and Cu(II) in pyridine and N,N-dimethylformamide (DMF). Dodecaphenyl substitution produces a weaker ring distortion in the more aromatic tetrabenzoporphyrin compared with porphyrins themselves. Irrespective of the degree of macroring nonplanarity, the Zn (11) and Cu complexes of tetrabenzoporphyrins with increasing degree of meso-phenyl substitution meet a spectral stability criterion.

  DOI：

  10.1023/b:rugc.0000007663.33757.32

文献信息

• Reinvestigation of synthetic methods for zinc meso-tetraphenyltetrabenzoporphyrin
  作者：Kunihiro Ichimura、Masako Sakuragi、Hisayuki Morii、Madoka Yasuike、Masaru Fukui、Osamu Ohno

  DOI：10.1016/s0020-1693(00)85087-2

  日期：1990.10
• ——
  作者：N. E. Galanin、E. V. Kudrik、G. P. Shaposhnikov

  DOI：10.1023/a:1020715202738

  日期：——

  meso-Monophenyltetrabenzoporphine and its zinc complex were synthesized starting from 3-(3-oxo-2,3-dihydro-1H-isoindol-1-yiidenemethyl)-1H-isoindol-1-one. The effect of unsymmetrical meso-substitution on physical and spectral properties of the products is discussed. The results of quantum-chemical calculations suggest spatial distortion of the porphyrin macroring.