return to home page 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 SiCl2 (Dichlorosilylene) 1A1 C2V

1910171554
InChI=1S/Cl2Si/c1-3-2 INChIKey=BUMGIEFFCMBQDG-UHFFFAOYSA-N

LSDA/6-311G*


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Si1 0.0000 0.0000 0.9351   0.9351 0.0000 0.0000
Cl2 0.0000 1.6148 -0.3850   -0.3850 0.0000 1.6148
Cl3 0.0000 -1.6148 -0.3850   -0.3850 0.0000 -1.6148
Atom - Atom Distances (Å)
  Si1 Cl2 Cl3
Si1 2.0858 2.0858
Cl2 2.0858 3.2297
Cl3 2.0858 3.2297
Maximum atom distance is 3.2297Å between atoms Cl2 and Cl3.
picture of Dichlorosilylene
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Cl2 Si1 Cl3 101.468

For information on specific bond angles or dihedrals see the geometry comparison page in section Comparisons > Geometry > Bonds, angles.