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Geometry for CH3Cl (Methyl chloride) 1A1 C3V

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

MP2=FULL/6-31G**


Point group is C3v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 -1.1193   -1.1193 0.0000 0.0000
Cl2 0.0000 0.0000 0.6548   0.6548 0.0000 0.0000
H3 0.0000 1.0245 -1.4716   -1.4716 1.0203 -0.0928
H4 0.8872 -0.5122 -1.4716   -1.4716 -0.4298 0.9299
H5 -0.8872 -0.5122 -1.4716   -1.4716 -0.5905 -0.8372
Atom - Atom Distances (Å)
  C1 Cl2 H3 H4 H5
C1 1.7741 1.0833 1.0833 1.0833
Cl2 1.7741 2.3602 2.3602 2.3602
H3 1.0833 2.3602 1.7744 1.7744
H4 1.0833 2.3602 1.7744 1.7744
H5 1.0833 2.3602 1.7744 1.7744
Maximum atom distance is 2.3602Å between atoms Cl2 and H3.
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 108.973 Cl2 C1 H4 108.973
Cl2 C1 H5 108.973 H3 C1 H4 109.965
H3 C1 H5 109.965 H4 C1 H5 109.965

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