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Geometry for CH2BrCl (Methane, bromochloro-) 1A' CS

1910171554
InChI=1S/CH2BrCl/c2-1-3/h1H2 INChIKey=JPOXNPPZZKNXOV-UHFFFAOYSA-N

HF/6-31G


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 1.0479 0.0000   -0.5787 0.8736 0.0000
Br2 0.8714 -0.7128 0.0000   1.1201 -0.1130 0.0000
Cl3 -1.8284 0.9141 0.0000   -2.0292 -0.2477 0.0000
H4 0.2922 1.5596 0.8924   -0.6177 1.4616 0.8924
H5 0.2922 1.5596 -0.8924   -0.6177 1.4616 -0.8924
Atom - Atom Distances (Å)
  C1 Br2 Cl3 H4 H5
C1 1.9645 1.8333 1.0693 1.0693
Br2 1.9645 3.1521 2.5091 2.5091
Cl3 1.8333 3.1521 2.3896 2.3896
H4 1.0693 2.5091 2.3896 1.7847
H5 1.0693 2.5091 2.3896 1.7847
Maximum atom distance is 3.1521Å between atoms Br2 and Cl3.
picture of Methane, bromochloro-
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Br2 C1 Cl3 112.146
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Br2 C1 H4 107.916 Br2 C1 H5 107.916
Cl3 C1 H4 107.906 Cl3 C1 H5 107.906
H4 C1 H5 113.127

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