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Ring current models of porphyrin and conformational analysis of the dicarboxylate complex of SnIV porphyrin.

  作者 Iwamoto, Hajime;Fukazawa, Yoshimasa;  
  选自 期刊  Heterocycles;  卷期  2008年75-7;  页码  1711-1723  
  关联知识点  
 

[摘要]Several models for the porphyrin ring current effect are constructed based on a classical line current approxn. and their performances in reproducing the obsd. induced shifts of ligand protons in SnIV(porphyrin) dicarboxylate complexes are compared. A new model is selected and the diamagnetic ring current running on the inner 16p-electron circuit of the porphyrin is the main contributor together with a minor paratropic ring current on the outer 20p-electron circuit. Conformational analyses of bis(biphenyl carboxylate) complexes of SnIV(tetraphenylporphyrin) in soln. were carried out with this porphyrin ring current effect model.

 
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