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Geometry for CH2Br2 (dibromomethane) 1A1 C2V

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

CISD/6-31G


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 0.9767   0.9767 0.0000 0.0000
H2 -0.9044 0.0000 1.5768   1.5768 -0.9044 0.0000
H3 0.9044 0.0000 1.5768   1.5768 0.9044 0.0000
Br4 0.0000 1.6543 -0.1288   -0.1288 0.0000 1.6543
Br5 0.0000 -1.6543 -0.1288   -0.1288 0.0000 -1.6543
Atom - Atom Distances (Å)
  C1 H2 H3 Br4 Br5
C1 1.0854 1.0854 1.9897 1.9897
H2 1.0854 1.8088 2.5423 2.5423
H3 1.0854 1.8088 2.5423 2.5423
Br4 1.9897 2.5423 2.5423 3.3086
Br5 1.9897 2.5423 2.5423 3.3086
Maximum atom distance is 3.3086Å 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 112.497
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 C1 H3 112.871 H2 C1 Br4 107.889
H2 C1 Br5 107.889 H3 C1 Br4 107.889
H3 C1 Br5 107.889

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