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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 | |
HF/aug-cc-pV(T+d)Z
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| 1.74 | 1.76 | 1.78 | 1.80 | 1.82 | 1.84 | 1.86 | 1.88 | 1.90 | 1.92 | 1.94 | 1.96 | ||||||||||||||||||||||||||
| bond lengths (Å) | |||||||||||||||||||||||||||||||||||||
| Average bond length | Standard deviation |
|---|---|
| 1.841 | 0.082 |
| Species | Name | Bond Length (Å) | |
|---|---|---|---|
| Lowest value | SiC | silicon monocarbide | 1.759 |
| Highest value | SiH3CCl3 | (trichloromethyl)silane | 1.922 |
| Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
|---|---|---|---|---|
| SiC | silicon monocarbide | 1.759 | 1 | 2 |
| SiH3CCl3 | (trichloromethyl)silane | 1.922 | 1 | 2 |