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Compare vibrational frequencies in CCCBDB for C5H8 (1,3-Pentadiene, (Z)-)

HSEh1PBE/6-31G(2df,p)

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' 3260 3122   62 A'   3060  
2 A' 3184 3049   -11 A'   3060  
3 A' 3178 3043   28 A'   3015  
4 A' 3164 3030   32 A'   2998  
5 A' 3159 3026   28 A'   2998  
6 A' 3148 3015   77 A'   2938  
7 A' 3044 2915   -4 A'   2919  
8 A' 1743 1669   13 A'   1656  
9 A' 1684 1613   11 A'   1602  
10 A' 1486 1423   -22 A'   1445  
11 A' 1467 1405   -30 A'   1435  
12 A' 1411 1351   -40 A'   1391  
13 A' 1389 1330   -27 A'   1357  
14 A' 1315 1259   -41 A'   1300  
15 A' 1288 1233   -21 A'   1254  
16 A' 1191 1141   -28 A'   1169  
17 A' 1059 1014   -11 A'   1025  
18 A' 972 931   -33 A'   964  
19 A' 902 864   24 A'   840  
20 A' 615 589   -38 A'   627  
21 A' 385 368   -34 A'   402  
22 A' 215 206   62 A'   144  
23 A" 3100 2969   -6 A"   2975  
24 A" 1473 1411   -60 A"   1471  
25 A" 1055 1010   1 A"   1009  
26 A" 1051 1006   9 A"   997  
27 A" 1001 959   38 A"   921  
28 A" 937 897   -9 A"   906  
29 A" 815 780   7 A"   773  
30 A" 650 623   -4 A"   627  
31 A" 362 347   -109 A"   456  
32 A" 151 145   -26 A"   171  
33 A" 126 121           
The calculated vibrational frequencies were scaled by 0.9577

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.