The assignment of the photoelectron spectra of pyridine-N-oxides
β Scribed by Maier, J. P. (author);Muller, J. F. (author)
- Publisher
- Elsevier Science
- Year
- 1974
- Tongue
- French
- Weight
- 211 KB
- Volume
- 15
- Category
- Article
- ISSN
- 0040-4039
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π SIMILAR VOLUMES
The pyridine N-oxide system is an excellent one for demonstrating the usefulness of ultraviolet photoelectron spectroscopy in the measurement and interpretation of substituent effects. Band assignments are made in a straightforward manner, in accordance with recent SCF calculations on pyridine N-oxi
First adiabatic and vertical ionization energies were calculated by the density functional method using Becke's correlated functional for water, ammonia, the silyl radical, fivemembered heterocycles, and naphtalene. The structure of the ionic ground state and that of the neutral was optimized separa