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

CCD/6-311+G(3df,2p)

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' 3240 3056   -81 A'   3137  
2 A' 3120 2943   735 A'   2208  
3 A' 2351 2217   596 A'   1621  
4 A' 1738 1639   183 A'   1456  
5 A' 1522 1435           
6 A' 1253 1182   -33 A'   1215  
7 A' 953 899           
8 A' 641 604           
9 A' 258 243           
10 A" 1114 1051   -39 A"   1090  
11 A" 791 746           
12 A" 378 356           
The calculated vibrational frequencies were scaled by 0.9431

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.