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Compare vibrational frequencies in CCCBDB for C3H6O (Oxetane)

HSEh1PBE/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 3111 2971   12 A1   2959  
2 A1 3057 2918   -12 A1   2930  
3 A1 1549 1479   6 A1   1473  
4 A1 1494 1427   -34 A1   1461  
5 A1 1386 1323   -19 A1   1342  
6 A1 1074 1025   -109 A1   1134  
7 A1 959 916   -102 A1   1018  
8 A1 813 777   -131 A1   908  
9 A2 3099 2959   -41 A2   3000  
10 A2 1237 1181   -102 A2   1283  
11 A2 1168 1115   -70 A2   1185  
12 A2 841 803   -183 A2   986  
13 B1 3172 3029   22 B1   3007  
14 B1 3098 2958   18 B1   2940  
15 B1 1200 1146   -79 B1   1225  
16 B1 1154 1101   -41 B1   1142  
17 B1 772 737   -99 B1   836  
18 B1 25i 24i   -113 B1   90  
19 B2 3047 2910   -56 B2   2966  
20 B2 1518 1450   -58 B2   1508  
21 B2 1319 1259   -199 B2   1458  
22 B2 1268 1210   -153 B2   1363  
23 B2 1079 1031   -197 B2   1228  
24 B2 968 924   -12 B2   936  
The calculated vibrational frequencies were scaled by 0.9548

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.