return to home page Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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List of Scaled Vibrational Frequencies for C5H12S (Butane, 1-(methylthio)-) 1A' Cs

HF/6-31+G**


2975
2930
2888
2888
2877
2870
2862
1477
1466
1461
1458
1453
1399
1388
1355
1324
1242
1098
1024
995
964
873
753
708
410
306
232
114
2960
2937
2927
2907
2884
1464
1441
1304
1281
1208
1064
964
904
772
713
236
175
124
89
53