Article ID Journal Published Year Pages File Type
5374713 Chemical Physics 2011 9 Pages PDF
Abstract
► Stretching wavenumbers for intramolecularly hydrogen-bonded OH groups. ► Harmonic and second order perturbation theory anharmonic approximations. ► Computed harmonic and anharmonic wavenumbers linearly related. ► Linear correlations between observed and computed wavenumbers. ► Linear correlation with OH proton NMR chemical shifts.
Keywords
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Preview
OH stretching frequencies in systems with intramolecular hydrogen bonds: Harmonic and anharmonic analyses
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