ISSN:
1432-2234
Keywords:
Ionization potential
;
Oscillator strength
;
Spin-orbit coupling
;
Azabenzenes
Source:
Springer Online Journal Archives 1860-2000
Topics:
Chemistry and Pharmacology
Notes:
Abstract Transition energies, ionization potentials, dipole moments and oscillator strengths have been calculated for pyridine, pyrazine, pyrimidine, pyridazine, 3-cyanopyridine and 4-cyanopyridine by modified INDO-CI. Triplet radiative lifetimes have been calculated for these molecules.
Type of Medium:
Electronic Resource
URL:
http://dx.doi.org/10.1007/BF00526517
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