Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology | |
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B1B95/6-31G(2df,p)
5 | |||||||||||||||||||||||||
4 | |||||||||||||||||||||||||
3 | |||||||||||||||||||||||||
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1 | |||||||||||||||||||||||||
0 | |||||||||||||||||||||||||
2.15 | 2.16 | 2.16 | 2.17 | 2.17 | 2.18 | 2.18 | 2.19 | ||||||||||||||||||
bond lengths (Å) |
Average bond length | Standard deviation |
---|---|
2.168 | 0.013 |
Species | Name | Bond Length (Å) | |
---|---|---|---|
Lowest value | KO | Potassium monoxide | 2.155 |
Highest value | KOH | Potassium hydroxide | 2.181 |
Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
---|---|---|---|---|
KO | Potassium monoxide | 2.155 | 1 | 2 |
KOH | Potassium hydroxide | 2.181 | 1 | 2 |