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- W2364872582 abstract "Porphyrin derivatives have sensitive selectivity to molecular intercalation and aggregation in DNA helix. On the basis of the study of tetrapyridylporphine, in order to investigate the effects of meso-(p-methylpyridyl) to the structure of N-protonated porphyrin, the geometries of meso-tetrakis(p-methylpyridyl)porphyrin (TmPyPH_2 4+)and its diacid(TmPyPH_4 6+) were calculated by using AM1 MO method under certain symmetry restriction. The results show that in the protonation process, because of the effect of meso-(p-methylpyridyl), the changes of the structure and bond charge population are obvious; the frontier molecular orbitals have opposite change trend with the case of meso-yridyl,the rapid exchanges of inner hydrogens of the protonated diacid with solvent protons become more difficult." @default.
- W2364872582 created "2016-06-24" @default.
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- W2364872582 date "2001-01-01" @default.
- W2364872582 modified "2023-09-25" @default.
- W2364872582 title "Studies on the Structural Change of the N-Protonated Tetrapyridylporphine II.The Effects of the Substituting Group meso-(p-Methylpyridyl)" @default.
- W2364872582 hasPublicationYear "2001" @default.
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