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Geometry for SeF4 (Selenium tetrafluoride) 1A1 C2V

1910171554
InChI=1S/F4Se/c1-5(2,3)4 INChIKey=PMOBWAXBGUSOPS-UHFFFAOYSA-N

PBEPBEultrafine/6-311+G(3df,2p)


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Se1 0.0000 0.0000 0.3230   0.0000 0.0000 0.3230
F2 0.0000 1.8085 0.1774   1.8085 0.0000 0.1774
F3 0.0000 -1.8085 0.1774   -1.8085 0.0000 0.1774
F4 1.3294 0.0000 -0.7875   0.0000 1.3294 -0.7875
F5 -1.3294 0.0000 -0.7875   0.0000 -1.3294 -0.7875
Atom - Atom Distances (Å)
  Se1 F2 F3 F4 F5
Se1 1.8144 1.8144 1.7323 1.7323
F2 1.8144 3.6170 2.4432 2.4432
F3 1.8144 3.6170 2.4432 2.4432
F4 1.7323 2.4432 2.4432 2.6589
F5 1.7323 2.4432 2.4432 2.6589
Maximum atom distance is 3.6170Å between atoms F2 and F3.
picture of Selenium tetrafluoride
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
F2 Se1 F3 170.790 F2 Se1 F4 87.050
F2 Se1 F5 87.050 F3 Se1 F4 87.050
F3 Se1 F5 87.050 F4 Se1 F5 100.252

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