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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 | |
ROMP2/cc-pVTZ
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| 1.41 | 1.41 | 1.42 | 1.42 | 1.43 | 1.43 | 1.44 | 1.44 | ||||||||||||||||||
| bond lengths (Å) | |||||||||||||||||||||||||
| Average bond length | Standard deviation |
|---|---|
| 1.429 | 0.010 |
| Species | Name | Bond Length (Å) | |
|---|---|---|---|
| Lowest value | BeOH | beryllium monohydroxide | 1.411 |
| Highest value | Be(OH)2 | Beryllium hydroxide | 1.437 |
| Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
|---|---|---|---|---|
| BeO+ | Beryllium monoxide cation | 1.428 | 1 | 2 |
| BeOH | beryllium monohydroxide | 1.411 | 1 | 2 |
| Be(OH)2 | Beryllium hydroxide | 1.437 | 1 | 2 |
| 1.437 | 1 | 3 |