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Geometry for NaO2 (Sodium superoxide) 2A1 C2V

1910171554
InChI=1S/Na.O2/c;1-2/q+2;-2 INChIKey=

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


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Na1 0.0000 0.0000 1.1958   1.1958 0.0000 0.0000
O2 0.0000 0.6447 -0.8221   -0.8221 0.6447 0.0000
O3 0.0000 -0.6447 -0.8221   -0.8221 -0.6447 0.0000
Atom - Atom Distances (Å)
  Na1 O2 O3
Na1 2.1184 2.1184
O2 2.1184 1.2894
O3 2.1184 1.2894
Maximum atom distance is 2.1184Å between atoms Na1 and O2.
picture of Sodium superoxide
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Na1 O2 O3 72.281 Na1 O3 O2 72.281
O2 Na1 O3 35.438

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