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

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

B3LYP/6-31G**


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
S1 0.5416 0.1398 0.0000   -0.3868 -0.3792 0.1398
S2 -1.1509 0.9909 0.0000   0.8219 0.8057 0.9909
F3 0.5416 -1.0051 1.1803   0.4395 -1.2220 -1.0051
F4 0.5416 -1.0051 -1.1803   -1.2130 0.4637 -1.0051
Atom - Atom Distances (Å)
  S1 S2 F3 F4
S1 1.8945 1.6444 1.6444
S2 1.8945 2.8709 2.8709
F3 1.6444 2.8709 2.3606
F4 1.6444 2.8709 2.3606
Maximum atom distance is 2.8709Å 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 108.229 S2 S1 F4 108.229
F3 S1 F4 91.740

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