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

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

CCD/6-31G


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 1.0627 0.0000   -0.5844 0.8876 0.0000
Br2 0.8877 -0.7223 0.0000   1.1386 -0.1151 0.0000
Cl3 -1.8623 0.9256 0.0000   -2.0644 -0.2511 0.0000
H4 0.2950 1.5848 0.9092   -0.6252 1.4858 0.9092
H5 0.2950 1.5848 -0.9092   -0.6252 1.4858 -0.9092
Atom - Atom Distances (Å)
  C1 Br2 Cl3 H4 H5
C1 1.9936 1.8673 1.0891 1.0891
Br2 1.9936 3.2059 2.5497 2.5497
Cl3 1.8673 3.2059 2.4320 2.4320
H4 1.0891 2.5497 2.4320 1.8183
H5 1.0891 2.5497 2.4320 1.8183
Maximum atom distance is 3.2059Å 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 112.231
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Br2 C1 H4 107.978 Br2 C1 H5 107.978
Cl3 C1 H4 107.775 Cl3 C1 H5 107.775
H4 C1 H5 113.185

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