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 |
G3MP2
5 | |||||||||||||||||||||||||||||||
4 | |||||||||||||||||||||||||||||||
3 | |||||||||||||||||||||||||||||||
2 | |||||||||||||||||||||||||||||||
1 | |||||||||||||||||||||||||||||||
0 | |||||||||||||||||||||||||||||||
1.39 | 1.40 | 1.41 | 1.42 | 1.43 | 1.44 | 1.45 | 1.46 | 1.47 | 1.48 | ||||||||||||||||||||||
bond lengths (Å) |
Average bond length | Standard deviation |
---|---|
1.428 | 0.022 |
Species | Name | Bond Length (Å) | |
---|---|---|---|
Lowest value | SO+ | sulfur monoxide cation | 1.392 |
Highest value | SO | Sulfur monoxide | 1.466 |
Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
---|---|---|---|---|
SO | Sulfur monoxide | 1.466 | 1 | 2 |
SO+ | sulfur monoxide cation | 1.392 | 1 | 2 |
SO2 | Sulfur dioxide | 1.414 | 1 | 2 |
1.414 | 1 | 3 | ||
SSO | Disulfur monoxide | 1.436 | 1 | 2 |
C2H6O2S | Dimethyl sulfone | 1.437 | 1 | 2 |
1.437 | 1 | 3 |