CASPIAN JOURNAL

MANAGEMENT AND HIGH TECHNOLOGIES

Structure-dynamic models of ethylspinasarine and ehinohrome

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Structure-dynamic models of ethylspinasarine and ehinohrome  // Caspian journal : management and high technologies. — 2010. — №1. — pp. 44-50.

An analysis of vibrational spectra of ethylspinasarine and ehinohrome is carried out by the method of DFT/B3LYP/6-31G(d)*. The existence of internal hydrogen bonding is estimated.

Key words: vibrational spectra,ethylspinasarine,ehinohrome,conformation,internal hydrogen bonding.