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Compare vibrational frequencies in CCCBDB for CHONH2 (formamide)

MP2=FULL/6-31G**

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' 3850 3598   34 A'   3564  
2 A' 3696 3453   14 A'   3439  
3 A' 3068 2866   13 A'   2854  
4 A' 1847 1725   -29 A'   1754  
5 A' 1660 1551   -26 A'   1577  
6 A' 1461 1365   -25 A'   1390  
7 A' 1306 1220   -38 A'   1258  
8 A' 1072 1001   -44 A'   1046  
9 A' 566 529   -52 A'   581  
10 A" 1064 994   -27 A"   1021  
11 A" 653 610   8 A"   603  
12 A" 59i 55i   -344 A"   289  
The calculated vibrational frequencies were scaled by 0.9344

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.