An INDO study of the hyperfine coupling constants and equilibrium geometries of some tetra-atomic radicals
- 1 March 1973
- journal article
- research article
- Published by Taylor & Francis in Molecular Physics
- Vol. 25 (3), 707-712
- https://doi.org/10.1080/00268977300100641
Abstract
Equilibrium geometries and isotropic hyperfine coupling constants have been estimated for the series of radicals CH n F3-n , CH n Cl3-n , CCl n F3-n and S1H n F3-n using the INDO method. The theoretical hyperfine splittings agree well with experimental values including the unusually large proton splittings of 34·6 G and 89·9 G recently reported for SiH2F and SiHF2.Keywords
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