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Geometry for CH2Br (bromomethyl radical) 2A' CS

1910171554
InChI=1S/CH2Br/c1-2/h1H2 INChIKey=AOJDZKCUAATBGE-UHFFFAOYSA-N

TPSSh/6-31+G**


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 -0.0072 1.4927 0.0000   0.0001 -0.0072 1.4927
Br2 -0.0072 -0.3690 0.0000   0.0001 -0.0072 -0.3690
H3 0.1477 1.9791 0.9539   0.9513 0.1638 1.9791
H4 0.1477 1.9791 -0.9539   -0.9563 0.1316 1.9791
Atom - Atom Distances (Å)
  C1 Br2 H3 H4
C1 1.8617 1.0819 1.0819
Br2 1.8617 2.5392 2.5392
H3 1.0819 2.5392 1.9078
H4 1.0819 2.5392 1.9078
Maximum atom distance is 2.5392Å between atoms Br2 and H3.
picture of bromomethyl radical
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Br2 C1 H3 116.716 Br2 C1 H4 116.716
H3 C1 H4 123.693

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