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Compare vibrational frequencies in CCCBDB for P(CH3)3 (trimethylphosphine)

QCISD(T)=FULL/6-31+G**

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 A1 3160 3160           
2 A1 3066 3066   175 A1   2891  
3 A1 1502 1502   81 A1   1421  
4 A1 1391 1391   87 A1   1304  
5 A1 997 997   51 A1   946  
6 A1 664 664   14 A1   650  
7 A1 287 287   -12 A1   299  
8 A2 3176 3176    A2      
9 A2 1488 1488   67 A2   1421  
10 A2 811 811    A2      
11 A2 161 161    A2      
12 E 3176 3176   210 E   2966  
13 E 3160 3160   208 E   2952  
14 E 3068 3068   177 E   2891  
15 E 1503 1503   82 E   1421  
16 E 1490 1490   69 E   1421  
17 E 1365 1365   73 E   1292  
18 E 984 984   38 E   946  
19 E 864 864   -67 E   931  
20 E 725 725   21 E   704  
21 E 254 254    E      
22 E 196 196   -63 E   259  
The calculated vibrational frequencies were scaled by 1

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.