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Geometry for SF5 (Sulfur pentafluoride) 2A1 C4V

1910171554
InChI=1S/F5S/c1-6(2,3,4)5 INChIKey=HAQZDUWRNKKMQY-UHFFFAOYSA-N

PBEPBEultrafine/cc-pVTZ


Point group is C4v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
S1 0.0000 0.0000 0.2004   0.0000 0.0000 0.2004
F2 0.0000 0.0000 -1.3819   0.0000 0.0000 -1.3819
F3 0.0000 1.6552 0.2564   1.5563 -0.5636 0.2564
F4 -1.6552 0.0000 0.2564   -0.5636 -1.5563 0.2564
F5 0.0000 -1.6552 0.2564   -1.5563 0.5636 0.2564
F6 1.6552 0.0000 0.2564   0.5636 1.5563 0.2564
Atom - Atom Distances (Å)
  S1 F2 F3 F4 F5 F6
S1 1.5822 1.6562 1.6562 1.6562 1.6562
F2 1.5822 2.3289 2.3289 2.3289 2.3289
F3 1.6562 2.3289 2.3409 3.3105 2.3409
F4 1.6562 2.3289 2.3409 2.3409 3.3105
F5 1.6562 2.3289 3.3105 2.3409 2.3409
F6 1.6562 2.3289 2.3409 3.3105 2.3409
Maximum atom distance is 3.3105Å between atoms F3 and F5.
picture of Sulfur pentafluoride
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
F2 S1 F3 91.940 F2 S1 F4 91.940
F2 S1 F5 91.940 F2 S1 F6 91.940
F3 S1 F4 89.934 F3 S1 F5 176.120
F3 S1 F6 89.934 F4 S1 F5 89.934
F4 S1 F6 176.120 F5 S1 F6 89.934

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