Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology | |
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TPSSh/6-31G
5 | ||||||||||||||||||||||||||||
4 | ||||||||||||||||||||||||||||
3 | ||||||||||||||||||||||||||||
2 | ||||||||||||||||||||||||||||
1 | ||||||||||||||||||||||||||||
0 | ||||||||||||||||||||||||||||
2.16 | 2.18 | 2.20 | 2.22 | 2.24 | 2.26 | 2.28 | 2.30 | 2.32 | ||||||||||||||||||||
bond lengths (Å) |
Average bond length | Standard deviation |
---|---|
2.252 | 0.053 |
Species | Name | Bond Length (Å) | |
---|---|---|---|
Lowest value | GeCl+ | Germanium monochloride cation | 2.161 |
Highest value | GeCl | Germanium monochloride | 2.283 |
Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
---|---|---|---|---|
GeCl | Germanium monochloride | 2.283 | 1 | 2 |
GeCl+ | Germanium monochloride cation | 2.161 | 1 | 2 |
GeCl2 | Germanium dichloride | 2.283 | 1 | 2 |
2.283 | 1 | 3 |