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Geometry for CH2Br2 (dibromomethane) 1A1 C2V

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

HSEh1PBE/daug-cc-pVDZ


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 0.9340   0.0000 0.9340 0.0000
H2 -0.9064 0.0000 1.5421   0.0000 1.5421 -0.9064
H3 0.9064 0.0000 1.5421   0.0000 1.5421 0.9064
Br4 0.0000 1.6148 -0.1241   1.6148 -0.1241 0.0000
Br5 0.0000 -1.6148 -0.1241   -1.6148 -0.1241 0.0000
Atom - Atom Distances (Å)
  C1 H2 H3 Br4 Br5
C1 1.0915 1.0915 1.9306 1.9306
H2 1.0915 1.8127 2.4911 2.4911
H3 1.0915 1.8127 2.4911 2.4911
Br4 1.9306 2.4911 2.4911 3.2297
Br5 1.9306 2.4911 2.4911 3.2297
Maximum atom distance is 3.2297Å 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 113.533
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 C1 H3 112.280 H2 C1 Br4 107.780
H2 C1 Br5 107.780 H3 C1 Br4 107.780
H3 C1 Br5 107.780

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