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Geometry for BrOBr (Bromine oxide) 1A1 C2V

1910171554
InChI=1S/Br2O/c1-3-2 INChIKey=HJCMMOODWZOXML-UHFFFAOYSA-N

B3LYP/STO-3G


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
O1 0.0000 0.0000 0.9659   0.9659 0.0000 0.0000
Br2 0.0000 1.5786 -0.1104   -0.1104 0.0000 1.5786
Br3 0.0000 -1.5786 -0.1104   -0.1104 0.0000 -1.5786
Atom - Atom Distances (Å)
  O1 Br2 Br3
O1 1.9106 1.9106
Br2 1.9106 3.1571
Br3 1.9106 3.1571
Maximum atom distance is 3.1571Å between atoms Br2 and Br3.
picture of Bromine oxide
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Br2 O1 Br3 111.425

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