A relation between stretching force constants, bond covalency and ionization potentials
β Scribed by Robert Becker; Wolfgang Sawodny
- Publisher
- Elsevier Science
- Year
- 1975
- Tongue
- English
- Weight
- 709 KB
- Volume
- 29
- Category
- Article
- ISSN
- 0022-2860
No coin nor oath required. For personal study only.
π SIMILAR VOLUMES
Using 25 accurately known bond-stretching force constants and bond lengths for 23 molecules, a relation of the form: F' = 37.3 r 5 35 has been obtained for carbon-nitrogen bonds. The root-mean-square deviation between the force constant values reported in the literature and those calculated from the
## Abstract The Oο£ΏH bond length and the quadratic, cubic, and quartic stretching force constants, calculated __ab initio__ using the unscaled 4β31G basis set with full geometry optimization, are reported for 30 planar conformers of ten molecules contaning either the Cο£ΏOH, Nο£ΏOH, or Oο£ΏOH group. The d