Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology | |
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B2PLYP/cc-pVTZ-PP
5 | |||||||||||||||||||||||||||||||
4 | |||||||||||||||||||||||||||||||
3 | |||||||||||||||||||||||||||||||
2 | |||||||||||||||||||||||||||||||
1 | |||||||||||||||||||||||||||||||
0 | |||||||||||||||||||||||||||||||
2.19 | 2.19 | 2.19 | 2.19 | 2.19 | 2.19 | 2.19 | 2.19 | 2.19 | 2.19 | ||||||||||||||||||||||
bond lengths (Å) |
Average bond length | Standard deviation |
---|---|
2.191 | 0.003 |
Species | Name | Bond Length (Å) | |
---|---|---|---|
Lowest value | GeCl | Germanium monochloride | 2.187 |
Highest value | GeCl2 | Germanium dichloride | 2.194 |
Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
---|---|---|---|---|
GeCl | Germanium monochloride | 2.187 | 1 | 2 |
GeCl2 | Germanium dichloride | 2.194 | 1 | 2 |
2.194 | 1 | 3 |