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Geometry for S2F2 (Thio-thionyl fluoride) 1A' CS

1910171554
InChI=1S/F2S2/c1-4(2)3 INChIKey=KBYVSSUWTLBZTB-UHFFFAOYSA-N

B97D3/aug-cc-pVTZ


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
S1 0.5381 0.1469 0.0000   -0.2581 0.0000 0.4945
S2 -1.1435 0.9860 0.0000   1.5005 0.0000 -0.1683
F3 0.5381 -1.0070 1.2039   -1.1043 1.2039 -0.2900
F4 0.5381 -1.0070 -1.2039   -1.1043 -1.2039 -0.2900
Atom - Atom Distances (Å)
  S1 S2 F3 F4
S1 1.8794 1.6676 1.6676
S2 1.8794 2.8722 2.8722
F3 1.6676 2.8722 2.4078
F4 1.6676 2.8722 2.4078
Maximum atom distance is 2.8722Å between atoms S2 and F3.
picture of Thio-thionyl fluoride
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
S2 S1 F3 107.995 S2 S1 F4 107.995
F3 S1 F4 92.430

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