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Compare vibrational frequencies in CCCBDB for CF2O (Carbonic difluoride)

BLYP/STO-3G

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 A1 1814 1678   -250 A1   1928  
2 A1 912 844   -121 A1   965  
3 A1 471 436   -148 A1   584  
4 B1 584 541   -233 B1   774  
5 B2 1264 1170   -79 B2   1249  
6 B2 505 467   -159 B2   626  
The calculated vibrational frequencies were scaled by 0.9252

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.