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Geometry for CH2Br2 (dibromomethane) 1A1 C2V

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

HF/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 0.9310   0.9310 0.0000 0.0000
H2 -0.8878 0.0000 1.5305   1.5305 -0.8878 0.0000
H3 0.8878 0.0000 1.5305   1.5305 0.8878 0.0000
Br4 0.0000 1.6118 -0.1235   -0.1235 0.0000 1.6118
Br5 0.0000 -1.6118 -0.1235   -0.1235 0.0000 -1.6118
Atom - Atom Distances (Å)
  C1 H2 H3 Br4 Br5
C1 1.0712 1.0712 1.9261 1.9261
H2 1.0712 1.7755 2.4742 2.4742
H3 1.0712 1.7755 2.4742 2.4742
Br4 1.9261 2.4742 2.4742 3.2235
Br5 1.9261 2.4742 2.4742 3.2235
Maximum atom distance is 3.2235Å 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 113.608
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 C1 H3 111.941 H2 C1 Br4 107.842
H2 C1 Br5 107.842 H3 C1 Br4 107.842
H3 C1 Br5 107.842

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