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Geometry for CH2Br (bromomethyl radical) 2A' CS

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

mPW1PW91/6-31+G**


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 -0.0001 1.4791 0.0000   0.0000 -0.0001 1.4791
Br2 -0.0001 -0.3668 0.0000   0.0000 -0.0001 -0.3668
H3 0.0019 1.9816 0.9544   0.9544 0.0068 1.9816
H4 0.0019 1.9816 -0.9544   -0.9544 -0.0031 1.9816
Atom - Atom Distances (Å)
  C1 Br2 H3 H4
C1 1.8459 1.0786 1.0786
Br2 1.8459 2.5349 2.5349
H3 1.0786 2.5349 1.9088
H4 1.0786 2.5349 1.9088
Maximum atom distance is 2.5349Å 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 117.768 Br2 C1 H4 117.768
H3 C1 H4 124.464

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