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Compare vibrational frequencies in CCCBDB for F2SO (Thionyl Fluoride)

B1B95/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 A' 1095 967   -368 A'   1335  
2 A' 786 694   -114 A'   808  
3 A' 392 346   -184 A'   530  
4 A' 273 241   -137 A'   378  
5 A" 723 638   -109 A"   747  
6 A" 299 264   -128 A"   393  
The calculated vibrational frequencies were scaled by 0.883

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.