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Geometry for OClO (Chlorine dioxide) 2B1 C2V

1910171554
InChI=1S/ClO2/c2-1-3 INChIKey=OSVXSBDYLRYLIG-UHFFFAOYSA-N

PBEPBEultrafine/cc-pVTZ


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Cl1 0.0000 0.0000 0.3805   0.3805 0.0000 0.0000
O2 0.0000 1.2987 -0.4043   -0.4043 0.0000 1.2987
O3 0.0000 -1.2987 -0.4043   -0.4043 0.0000 -1.2987
Atom - Atom Distances (Å)
  Cl1 O2 O3
Cl1 1.5175 1.5175
O2 1.5175 2.5975
O3 1.5175 2.5975
Maximum atom distance is 2.5975Å between atoms O2 and O3.
picture of Chlorine dioxide
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O2 Cl1 O3 117.708

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