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Compare vibrational frequencies in CCCBDB for H3PO (Phosphine oxide)

MP2/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 2697 2351   -8 A1   2359  
2 A1 1393 1215   -25 A1   1240  
3 A1 954 832   -312 A1   1144  
4 E 2693 2348   -23 E   2372  
5 E 1320 1151   37 E   1114  
6 E 671 585   -268 E   853  
The calculated vibrational frequencies were scaled by 0.8719

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.