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IV.C.1. (XIII.D.1.)

Compare vibrational frequencies in CCCBDB for ONONO (Nitrosyl nitrite)

CCD/cc-pVTZ

Frequency in cm-1
  Calculated   Experimental
Mode Number Symmetry Frequency diff Symmetry Frequency Comment
1 A1 1733 -7 A1 1740  
2 A1 1016 43 A1 974  
3 A1 456 61 A1 395  
4 A1 264        
5 A2 226 16 A2 210  
6 B1 135 -5 B1 140  
7 B2 1684 -13 B2 1697  
8 B2 737 32 B2 705  
9 B2 558 178 B2 380  
The calculated vibrational frequencies were scaled by 0.9337

See section XIII.C.3 List or set vibrational scaling factors to change the scale factors used here.
See section III.B.3.c Calculate a vibrational scaling factor for a set of molecules to determine the least squares best scaling factor.
See section III.B.3.b List of vibrational scaling factors and their uncertainties for information on where the above scaling factor is from.