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Geometry for COBr2 (Carbonic dibromide) 1A1 C2V

1910171554
InChI=1S/CBr2O/c2-1(3)4 INChIKey=MOIPGXQKZSZOQX-UHFFFAOYSA-N

LSDA/6-311G*


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 0.7775   0.7775 0.0000 0.0000
O2 0.0000 0.0000 1.9503   1.9503 0.0000 0.0000
Br3 0.0000 1.5867 -0.2895   -0.2895 0.0000 1.5867
Br4 0.0000 -1.5867 -0.2895   -0.2895 0.0000 -1.5867
Atom - Atom Distances (Å)
  C1 O2 Br3 Br4
C1 1.1728 1.9121 1.9121
O2 1.1728 2.7449 2.7449
Br3 1.9121 2.7449 3.1734
Br4 1.9121 2.7449 3.1734
Maximum atom distance is 3.1734Å between atoms Br3 and Br4.
picture of Carbonic dibromide
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O2 C1 Br3 123.921 O2 C1 Br4 123.921
Br3 C1 Br4 112.158

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