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Geometry for CH3Cl (Methyl chloride) 1A1 C3V

1910171554
InChI=1S/CH3Cl/c1-2/h1H3 INChIKey=NEHMKBQYUWJMIP-UHFFFAOYSA-N

HF/aug-cc-pVTZ


Point group is C3v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 -1.1296   -1.1296 0.0000 -0.0000
Cl2 0.0000 0.0000 0.6573   0.6573 0.0000 0.0000
H3 0.0000 1.0224 -1.4655   -1.4655 -1.0224 -0.0000
H4 0.8854 -0.5112 -1.4655   -1.4655 0.5112 -0.8854
H5 -0.8854 -0.5112 -1.4655   -1.4655 0.5112 0.8854
Atom - Atom Distances (Å)
  C1 Cl2 H3 H4 H5
C1 1.7869 1.0761 1.0761 1.0761
Cl2 1.7869 2.3562 2.3562 2.3562
H3 1.0761 2.3562 1.7708 1.7708
H4 1.0761 2.3562 1.7708 1.7708
H5 1.0761 2.3562 1.7708 1.7708
Maximum atom distance is 2.3562Å between atoms Cl2 and H4.
picture of Methyl chloride
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
Cl2 C1 H3 108.187 Cl2 C1 H4 108.187
Cl2 C1 H5 108.187 H3 C1 H4 110.724
H3 C1 H5 110.724 H4 C1 H5 110.724

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