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

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

HF/SDD


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 1.0445 0.0000   0.5907 -0.8614 0.0000
Br2 0.8746 -0.7198 0.0000   -1.1284 0.0990 0.0000
Cl3 -1.8352 0.9301 0.0000   2.0396 0.2708 0.0000
H4 0.2945 1.5573 0.8918   0.6378 -1.4509 0.8918
H5 0.2945 1.5573 -0.8918   0.6378 -1.4509 -0.8918
Atom - Atom Distances (Å)
  C1 Br2 Cl3 H4 H5
C1 1.9692 1.8388 1.0700 1.0700
Br2 1.9692 3.1726 2.5134 2.5134
Cl3 1.8388 3.1726 2.3926 2.3926
H4 1.0700 2.5134 2.3926 1.7836
H5 1.0700 2.5134 2.3926 1.7836
Maximum atom distance is 3.1726Å 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 112.800
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Br2 C1 H4 107.885 Br2 C1 H5 107.885
Cl3 C1 H4 107.730 Cl3 C1 H5 107.730
H4 C1 H5 112.903

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