Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology | |
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HF/LANL2DZ
5 | ||||||||||||||||||||||||||||||||||
4 | ||||||||||||||||||||||||||||||||||
3 | ||||||||||||||||||||||||||||||||||
2 | ||||||||||||||||||||||||||||||||||
1 | ||||||||||||||||||||||||||||||||||
0 | ||||||||||||||||||||||||||||||||||
2.00 | 2.05 | 2.10 | 2.15 | 2.20 | 2.25 | 2.30 | 2.35 | 2.40 | 2.45 | 2.50 | ||||||||||||||||||||||||
bond lengths (Å) |
Average bond length | Standard deviation |
---|---|
2.190 | 0.154 |
Species | Name | Bond Length (Å) | |
---|---|---|---|
Lowest value | SiP- | Silicon monophosphide anion | 2.035 |
Highest value | SiP+ | Silicon monophosphide cation | 2.400 |
Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
---|---|---|---|---|
SiP- | Silicon monophosphide anion | 2.035 | 1 | 2 |
SiP | Silicon monophosphide | 2.134 | 1 | 2 |
SiP+ | Silicon monophosphide cation | 2.400 | 1 | 2 |