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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 | |
MP2/CEP-121G
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| 2.00 | 2.01 | 2.02 | 2.03 | 2.04 | 2.05 | 2.06 | 2.07 | 2.08 | 2.09 | 2.10 | ||||||||||||||||||||||||
| bond lengths (Å) | ||||||||||||||||||||||||||||||||||
| Average bond length | Standard deviation |
|---|---|
| 2.029 | 0.036 |
| Species | Name | Bond Length (Å) | |
|---|---|---|---|
| Lowest value | Al(CH3)3 | trimethyl aluminum | 2.000 |
| Highest value | AlCN | Aluminum monocyanide | 2.085 |
| Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
|---|---|---|---|---|
| AlC | Aluminum carbide | 2.062 | 1 | 2 |
| AlCN | Aluminum monocyanide | 2.085 | 1 | 2 |
| Al(CH3)3 | trimethyl aluminum | 2.000 | 1 | 2 |
| 2.000 | 1 | 3 | ||
| 2.000 | 1 | 4 |