Heats of Formation and Vibrational Spectra of Two Isomers of S2F2. G2, G3, and CBS-QB3 Calculations
Journal of Molecular Structure - THEOCHEM
The optimized geometries, vibrational frequencies, and heats of formation of disulfur difluoride, FSSF, and thiothionyl fluoride, SySF2, have been determined using G2 theory, G3 theory, and a complete basis set method. Comparison to previously published values is made.
Ball, D. W. Heats of formation and vibrational spectra of two isomers of S2F2. G2, G3, and CBS-QB3 calculations. Journal of Molecular Structure: THEOCHEM 2004, 676, 15-18.