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Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology |
| You are here: Calculated > Geometry > Calculated geometry > One type of bond | |
PBE1PBE/6-311+G(3df,2p)
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| 1.40 | 1.40 | 1.41 | 1.41 | 1.41 | 1.41 | 1.41 | 1.42 | 1.42 | 1.42 | 1.42 | 1.42 | 1.43 | ||||||||||||||||||||||||||||
| bond lengths (Å) | ||||||||||||||||||||||||||||||||||||||||
| Average bond length | Standard deviation |
|---|---|
| 1.413 | 0.009 |
| Species | Name | Bond Length (Å) | |
|---|---|---|---|
| Lowest value | HOF | Hypofluorous acid | 1.403 |
| Highest value | FOO+ | Fluorine dioxide cation | 1.425 |
| Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
|---|---|---|---|---|
| HOF | Hypofluorous acid | 1.403 | 1 | 3 |
| FOO+ | Fluorine dioxide cation | 1.425 | 2 | 3 |
| ClOF | Chlorine hypofluorite | 1.411 | 2 | 3 |