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Compare vibrational frequencies in CCCBDB for FSSF (Difluorodisulfane)

CCD/6-31G

18 11 26 13 55
Frequency in cm-1
  Calculated   Experimental
Mode Number Symmetry Frequency Scaled
Frequency
Harm.
diff
Fund.
diff
Symmetry Harmonic
Frequency
Fundamental
Frequency
Comment
1 A 710 681   -36 A   717  
2 A 403 386   -229 A   615  
3 A 197 189   -112 A   301  
4 A 126 120   -63 A   183  
5 B 705 676   -5 B   681  
6 B 235 225   -95 B   320  
The calculated vibrational frequencies were scaled by 0.9595

See section Calculated; Vibrations; Scale Factors; Set scaling factors to change the scale factors used here.
See section Calculated; Vibrations; Scale Factors; Calculate a scale factor to determine the least squares best scaling factor.
See section Calculated; Vibrations; Scale Factors; Scale factor uncertainty for information on where the above scaling factor is from.