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Geometry for CHCl2 (dichloromethyl radical) 2A' CS

1910171554
InChI=1S/CHCl2/c2-1-3/h1H INChIKey=ZJULYDCRWUEPTK-UHFFFAOYSA-N

HSEh1PBE/3-21G


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0145 0.7574 0.0000   0.0000 0.7533 0.0798
H2 -0.5811 1.6601 0.0000   0.0000 1.7040 -0.4357
Cl3 0.0145 -0.1825 1.5224   1.5224 -0.1830 -0.0013
Cl4 0.0145 -0.1825 -1.5224   -1.5224 -0.1830 -0.0013
Atom - Atom Distances (Å)
  C1 H2 Cl3 Cl4
C1 1.0815 1.7891 1.7891
H2 1.0815 2.4632 2.4632
Cl3 1.7891 2.4632 3.0448
Cl4 1.7891 2.4632 3.0448
Maximum atom distance is 3.0448Å between atoms Cl3 and Cl4.
picture of dichloromethyl radical
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Cl3 C1 Cl4 116.623
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Cl3 C1 H2 116.006 Cl4 C1 H2 116.006

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