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Compare vibrational frequencies in CCCBDB for C2Cl2 (dichloroacetylene)

HSEh1PBE/3-21G

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 Σg 2426 2337   103 Σg+   2234  
2 Σg 445 428   -49 Σg+   477  
3 Σu 927 893   -95 Σu+   988  
4 Πg 637 613   280 Πg   333  
5 Πu 205 197   25 Πu   172  
The calculated vibrational frequencies were scaled by 0.9633

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.