Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology | |
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MP2/STO-3G
5 | ||||||||||||||||||||||||||||
4 | ||||||||||||||||||||||||||||
3 | ||||||||||||||||||||||||||||
2 | ||||||||||||||||||||||||||||
1 | ||||||||||||||||||||||||||||
0 | ||||||||||||||||||||||||||||
2.15 | 2.15 | 2.15 | 2.15 | 2.15 | 2.15 | 2.15 | 2.15 | 2.15 | ||||||||||||||||||||
bond lengths (Å) |
Average bond length | Standard deviation |
---|---|
2.150 | 0.001 |
Species | Name | Bond Length (Å) | |
---|---|---|---|
Lowest value | SeS- | selenium monosulfide anion | 2.149 |
Highest value | SeS+ | selenium monosulfide cation | 2.152 |
Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
---|---|---|---|---|
SeS- | selenium monosulfide anion | 2.149 | 1 | 2 |
SeS+ | selenium monosulfide cation | 2.152 | 1 | 2 |