Functionalized perfluoropolyethers are investigated by infrared spectroscopy with the aim to give a quantitative estimate of the carboxylic acid groups species; since hydrogen bonded moieties have been observed, also the relative distribution of the associated species has been determined. The study is based both on measured and on theoretically predicted infrared intensities, as obtained by density functional theory (DFT) calculations on model systems.

Infrared intensity studies in fluorinated macromolecules

MILANI, ALBERTO;TOMMASINI, MATTEO MARIA SAVERIO;CASTIGLIONI, CHIARA;ZERBI, GIUSEPPE
2008-01-01

Abstract

Functionalized perfluoropolyethers are investigated by infrared spectroscopy with the aim to give a quantitative estimate of the carboxylic acid groups species; since hydrogen bonded moieties have been observed, also the relative distribution of the associated species has been determined. The study is based both on measured and on theoretically predicted infrared intensities, as obtained by density functional theory (DFT) calculations on model systems.
2008
density functional theory simulations; hydrogen bonds; infrared spectroscopy; perfluoropolyethers
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Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/11311/544568
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