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Spectral and energy characteristics of dioxybenzenes
- Source :
- Journal of Applied Spectroscopy. 71:788-793
- Publication Year :
- 2004
- Publisher :
- Springer Science and Business Media LLC, 2004.
-
Abstract
- In the approximation for the valence force field with quantum-chemical estimation of the intensities of the absorption bands of IR spectra, calculation of the main spectral-structural and energy characteristics of dioxy-benzenes is performed. This made it possible to suggest energetically more favorable conformations and assign the frequencies of normal vibrations to individual types of symmetry.
Details
- ISSN :
- 15738647 and 00219037
- Volume :
- 71
- Database :
- OpenAIRE
- Journal :
- Journal of Applied Spectroscopy
- Accession number :
- edsair.doi...........8bf4b6af44be4fd305605e7a0b1d504d