Two-Dimensional Anharmonic Oscillator. Application to 2,5-Dihydrofuran
- 15 February 1972
- journal article
- research article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 56 (4) , 1444-1448
- https://doi.org/10.1063/1.1677387
Abstract
A program has been developed to calculate the energy levels and corresponding wavefunctions for a two‐dimensional anharmonic potential surface of at least C2v symmetry. This program has been employed to explain the high resolution splittings observed in the far infrared spectrum of 2,5‐dihydrofuran. The magnitude of the cross term connecting the ring‐twisting and ring‐puckering modes of 2,5‐dihydrofuran is sufficiently large to be significant. The potential surface determined also suggests that the ring‐twisting mode may be slightly anharmonic.Keywords
This publication has 8 references indexed in Scilit:
- Far-Infrared Spectra of Ring Compounds. VIII. The Effect of a Finite Central Barrier on Pseudorotation in Five-Membered RingsThe Journal of Chemical Physics, 1972
- Puckering structure in the infra-red spectrum of cyclobutaneMolecular Physics, 1970
- Far-Infrared Spectra of Ring Compounds. V. Ring-Puckering Potential Functions of Some Oxygen-Containing MoleculesThe Journal of Chemical Physics, 1969
- Ring Puckering in Five-Membered Rings. I. General TheoryThe Journal of Chemical Physics, 1969
- Far-Infrared Spectra of Ring Compounds. III. Spectrum, Structure, and Ring-Puckering Potential of SilacyclobutaneThe Journal of Chemical Physics, 1968
- Far-Infrared Spectra of Ring Compounds. II. The Spectrum and Ring-Puckering Potential Function of CyclopenteneThe Journal of Chemical Physics, 1967
- Ring-Puckering Motion of 2,5-DihydrofuranThe Journal of Chemical Physics, 1967
- Trimethylene Oxide. III. Far-Infrared Spectrum and Double-Minimum VibrationThe Journal of Chemical Physics, 1966