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Geometry for CH2Br2 (dibromomethane) 1A1 C2V

1910171554
InChI=1S/CH2Br2/c2-1-3/h1H2 INChIKey=FJBFPHVGVWTDIP-UHFFFAOYSA-N

CCSD=FULL/6-31G(2df,p)


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 0.9286   0.0000 0.9286 0.0000
H2 -0.8885 0.0000 1.5472   0.0000 1.5472 -0.8885
H3 0.8885 0.0000 1.5472   0.0000 1.5472 0.8885
Br4 0.0000 1.5780 -0.1238   1.5780 -0.1238 0.0000
Br5 0.0000 -1.5780 -0.1238   -1.5780 -0.1238 0.0000
Atom - Atom Distances (Å)
  C1 H2 H3 Br4 Br5
C1 1.0826 1.0826 1.8968 1.8968
H2 1.0826 1.7770 2.4641 2.4641
H3 1.0826 1.7770 2.4641 2.4641
Br4 1.8968 2.4641 2.4641 3.1561
Br5 1.8968 2.4641 2.4641 3.1561
Maximum atom distance is 3.1561Å between atoms Br4 and Br5.
picture of dibromomethane
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Br4 C1 Br5 112.603
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 C1 H3 110.307 H2 C1 Br4 108.482
H2 C1 Br5 108.482 H3 C1 Br4 108.482
H3 C1 Br5 108.482

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