6533b7d1fe1ef96bd125bb6e

RESEARCH PRODUCT

Complexes of Glycolic Acid with Nitrogen Isolated in Argon Matrices. II : Vibrational Overtone Excitations

Iwona KosendiakJussi M.e. AhokasJustyna KrupaJan LundellMaria Wierzejewska

subject

hydrogen bondtyppivärähtelytvetysidoksetkarboksyylihapotmatrix isolationvibrational overtonemolekyylitcarboxylic acidlaskennallinen kemiacomputational chemistryvibrational spectroscopy

description

Structural changes of glycolic acid (GA) complex with nitrogen induced by selective overtone excitation of the νOH mode were followed in argon matrices using FTIR spectroscopy. For the most stable SSC1 complex present in different trapping sites directly upon deposition site, selective changes in the νOH region were achieved upon near-infrared irradiation. Simultaneously, new conformers of the GA…N2 complex were formed, giving rise to several sets of bands in the νOH and νC=O regions of the spectra. Both position and intensity of new absorptions appeared to be highly sensitive on the wavelength of radiation used, as well as on the annealing of the matrix. Based on theoretical calculations at different levels of theory, an assignment of the observed bands is proposed and discussed. peerReviewed

http://urn.fi/URN:NBN:fi:jyu-201909124131