Abstract
Infrared spectra of 6-amino uracil (6AU), 6-amino-2-thio uracil (6A2TU) and their N-deuterated derivatives have been measured over the range 4000-200 cm −1. The fundamental frequencies of these molecules have been assigned on the basis of normal coordinate calculations carried out using a Urey—Bradley potential function supplemented with valence type constants for the out-of-plane modes of the planar skeleton. The results of the vibrational analysis are discussed and correlated with the assignments available for other related molecules.
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More From: Spectrochimica Acta Part A: Molecular Spectroscopy
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