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Compare vibrational frequencies in CCCBDB for H2CNCN (cyanamide, methylene)

PBEPBE/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' 3170 3126   -11 A'   3137  
2 A' 3031 2989   781 A'   2208  
3 A' 2156 2127   506 A'   1621  
4 A' 1642 1619   163 A'   1456  
5 A' 1499 1478           
6 A' 1187 1170   -45 A'   1215  
7 A' 917 905           
8 A' 545 537           
9 A' 236 233           
10 A" 1051 1036   -54 A"   1090  
11 A" 748 738           
12 A" 320 315           
The calculated vibrational frequencies were scaled by 0.9862

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.