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Eilatin: Semiempirical MO Calculations of Molecular Structures and Electronic Spectra of the Unprotonated and N-Protonated Molecules
Journal of Chemical Research, Synopses Pub Date : , DOI:10.1039/A803241F
Abstract

The molecular structures and electronic spectra of eilatin and protonated eilatin molecules have been investigated in terms of AM1 and CNDO/S methods, the calculated electronic spectra of free and monoprotonated eilatin molecules being in good agreement with the electronic spectra of eilatin observed in non-acidic and acidic media.

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