Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology | |
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MP4/6-311G*
5 | ||||||||||
4 | ||||||||||
3 | ||||||||||
2 | ||||||||||
1 | ||||||||||
0 | ||||||||||
0.91 | 0.92 | 0.93 | ||||||||
bond lengths (Å) |
Average bond length | Standard deviation |
---|---|
0.918 | 0.000 |
Species | Name | Bond Length (Å) | |
---|---|---|---|
Lowest value | HF | Hydrogen fluoride | 0.918 |
Highest value | HF | Hydrogen fluoride | 0.918 |
Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
---|---|---|---|---|
HF | Hydrogen fluoride | 0.918 | 1 | 2 |
DF | Hydrofluoric acid-d | 0.918 | 1 | 2 |