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Geometry for SOF4 (Sulfur tetrafluoride oxide) 1A1 C2V

1910171554
InChI=1S/F4OS/c1-6(2,3,4)5 INChIKey=DUGWRBKBGKTKOX-UHFFFAOYSA-N

BLYP/aug-cc-pVDZ


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
S1 0.0000 0.0000 0.1545   0.0000 0.0000 0.1545
O2 0.0000 0.0000 1.6295   0.0000 0.0000 1.6295
F3 0.0000 1.6773 -0.0820   1.6773 0.0000 -0.0820
F4 0.0000 -1.6773 -0.0820   -1.6773 0.0000 -0.0820
F5 1.3641 0.0000 -0.7795   0.0000 1.3641 -0.7795
F6 -1.3641 0.0000 -0.7795   0.0000 -1.3641 -0.7795
Atom - Atom Distances (Å)
  S1 O2 F3 F4 F5 F6
S1 1.4751 1.6939 1.6939 1.6532 1.6532
O2 1.4751 2.3964 2.3964 2.7684 2.7684
F3 1.6939 2.3964 3.3546 2.2717 2.2717
F4 1.6939 2.3964 3.3546 2.2717 2.2717
F5 1.6532 2.7684 2.2717 2.2717 2.7282
F6 1.6532 2.7684 2.2717 2.2717 2.7282
Maximum atom distance is 3.3546Å between atoms F3 and F4.
picture of Sulfur tetrafluoride oxide
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O2 S1 F3 98.025 O2 S1 F4 98.025
O2 S1 F5 124.399 O2 S1 F6 124.399
F3 S1 F4 163.951 F3 S1 F5 85.477
F3 S1 F6 85.477 F4 S1 F5 85.477
F4 S1 F6 85.477 F5 S1 F6 111.201

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