|
Computational Chemistry Comparison and Benchmark DataBase
Release 22 (May 2022) Standard Reference Database 101
National Institute of Standards and Technology
|
|
|
|
You are here: Home > Geometry > Calculated > Calculated geometry OR Calculated > Geometry > Calculated geometry
|
Geometry for SiCl (Clorosilylidyne)
2Π C*V
1910171554
InChI=1S/ClSi/c1-2 INChIKey=SLLGVCUQYRMELA-UHFFFAOYSA-N
PBEPBE/6-311G**
Point group is C∞v
| Atom |
Internal |
| x (Å) |
y (Å) |
z (Å) |
| Si1 |
0.0000 |
0.0000 |
-1.1539 |
| Cl2 |
0.0000 |
0.0000 |
0.9503 |
Atom - Atom Distances (Å)
| |
Si1 |
Cl2 |
| Si1 |
| 2.1042 |
| Cl2 |
2.1042 |
|
Maximum atom distance is 2.1042Å
between atoms Si1 and Cl2.
For information on specific bond angles or dihedrals
see the geometry comparison page in section
Comparisons > Geometry > Bonds, angles.