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 |
M06-2X/6-31G
5 | ||||||||||||||||||||||||||||||||||
4 | ||||||||||||||||||||||||||||||||||
3 | ||||||||||||||||||||||||||||||||||
2 | ||||||||||||||||||||||||||||||||||
1 | ||||||||||||||||||||||||||||||||||
0 | ||||||||||||||||||||||||||||||||||
2.14 | 2.15 | 2.16 | 2.17 | 2.18 | 2.19 | 2.20 | 2.21 | 2.22 | 2.23 | 2.24 | ||||||||||||||||||||||||
bond lengths (Å) |
Average bond length | Standard deviation |
---|---|
2.174 | 0.029 |
Species | Name | Bond Length (Å) | |
---|---|---|---|
Lowest value | SiCl3CH3 | methyltrichlorosilane | 2.149 |
Highest value | HSiCl | Chlorosilylene | 2.225 |
Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
---|---|---|---|---|
SiCl | Clorosilylidyne | 2.219 | 1 | 2 |
HSiCl | Chlorosilylene | 2.225 | 1 | 2 |
SiH3Cl | chlorosilane | 2.181 | 1 | 2 |
SiH2Cl2 | dichlorosilane | 2.161 | 1 | 4 |
2.161 | 1 | 5 | ||
SiCl3CH3 | methyltrichlorosilane | 2.149 | 1 | 3 |
2.149 | 1 | 4 | ||
2.149 | 1 | 5 |