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

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

BLYP/6-311G*


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
S1 0.5444 0.1524 0.0000   -0.2531 0.0000 0.5055
S2 -1.1568 1.0138 0.0000   1.5282 0.0000 -0.1750
F3 0.5444 -1.0367 1.2424   -1.1334 1.2424 -0.2938
F4 0.5444 -1.0367 -1.2424   -1.1334 -1.2424 -0.2938
Atom - Atom Distances (Å)
  S1 S2 F3 F4
S1 1.9069 1.7197 1.7197
S2 1.9069 2.9398 2.9398
F3 1.7197 2.9398 2.4848
F4 1.7197 2.9398 2.4848
Maximum atom distance is 2.9398Å 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 108.201 S2 S1 F4 108.201
F3 S1 F4 92.513

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