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Geometry for FOOF (Perfluoroperoxide) 1A C2

1910171554
InChI=1S/F2O2/c1-3-4-2 INChIKey=REAOZOPEJGPVCB-UHFFFAOYSA-N

B3LYP/6-31G(2df,p)


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
F1 0.5664 1.3427 -0.4847   1.4531 -0.4847 -0.1101
O2 0.5664 0.2729 0.5453   0.5016 0.5453 0.3790
O3 -0.5664 -0.2729 0.5453   -0.5016 0.5453 -0.3790
F4 -0.5664 -1.3427 -0.4847   -1.4531 -0.4847 0.1101
Atom - Atom Distances (Å)
  F1 O2 O3 F4
F1 1.4850 2.2257 2.9145
O2 1.4850 1.2574 2.2257
O3 2.2257 1.2574 1.4850
F4 2.9145 2.2257 1.4850
Maximum atom distance is 2.9145Å between atoms F1 and F4.
picture of Perfluoroperoxide
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
F1 O2 O3 108.220 O2 O3 F4 108.220

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