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Geometry for CH2Br2 (dibromomethane) 1A1 C2V

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

CID/daug-cc-pVTZ


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 0.9231   0.9231 0.0000 0.0000
H2 -0.8875 0.0000 1.5270   1.5270 -0.8875 0.0000
H3 0.8875 0.0000 1.5270   1.5270 0.8875 0.0000
Br4 0.0000 1.5985 -0.1228   -0.1228 0.0000 1.5985
Br5 0.0000 -1.5985 -0.1228   -0.1228 0.0000 -1.5985
Atom - Atom Distances (Å)
  C1 H2 H3 Br4 Br5
C1 1.0735 1.0735 1.9102 1.9102
H2 1.0735 1.7751 2.4626 2.4626
H3 1.0735 1.7751 2.4626 2.4626
Br4 1.9102 2.4626 2.4626 3.1970
Br5 1.9102 2.4626 2.4626 3.1970
Maximum atom distance is 3.1970Å 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 113.610
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 C1 H3 111.534 H2 C1 Br4 107.938
H2 C1 Br5 107.938 H3 C1 Br4 107.938
H3 C1 Br5 107.938

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