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 SiF2 (Silicon difluoride) 1A1 C2V

1910171554
InChI=1S/F2Si/c1-3-2 INChIKey=MGNHOGAVECORPT-UHFFFAOYSA-N

B2PLYP=FULL/aug-cc-pVDZ


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Si1 0.0000 0.0000 0.6020   0.0000 0.6020 0.0000
F2 0.0000 1.2618 -0.4682   1.2618 -0.4682 0.0000
F3 0.0000 -1.2618 -0.4682   -1.2618 -0.4682 0.0000
Atom - Atom Distances (Å)
  Si1 F2 F3
Si1 1.6546 1.6546
F2 1.6546 2.5236
F3 1.6546 2.5236
Maximum atom distance is 2.5236Å between atoms F2 and F3.
picture of Silicon difluoride
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
F2 Si1 F3 99.390

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