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Compare vibrational frequencies in CCCBDB for HCN+ (hydrogen cyanide cation)

MP2=FULL/cc-pVDZ

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 Σ 3939 3744   694 Σ   3050  
2 Σ 2929 2784   984 Σ   1800  
3 Π 960 912   152 Π   760  
The calculated vibrational frequencies were scaled by 0.9504

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.