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Geometry for CH3Li (methyl lithium) 1A1 C3V

1910171554
InChI=1S/CH3.Li/h1H3; INChIKey=DVSDBMFJEQPWNO-UHFFFAOYSA-N

B97D3/aug-cc-pVDZ


Point group is C3v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Li1 0.0000 0.0000 -1.6167   -1.6167 0.0000 0.0000
C2 0.0000 0.0000 0.3953   0.3953 0.0000 0.0000
H3 0.0000 1.0240 0.8262   0.8262 0.8914 -0.5039
H4 -0.8868 -0.5120 0.8262   0.8262 -0.8821 -0.5200
H5 0.8868 -0.5120 0.8262   0.8262 -0.0093 1.0239
Atom - Atom Distances (Å)
  Li1 C2 H3 H4 H5
Li1 2.0119 2.6488 2.6488 2.6488
C2 2.0119 1.1109 1.1109 1.1109
H3 2.6488 1.1109 1.7736 1.7736
H4 2.6488 1.1109 1.7736 1.7736
H5 2.6488 1.1109 1.7736 1.7736
Maximum atom distance is 2.6488Å between atoms Li1 and H4.
picture of methyl lithium
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
Li1 C2 H3 112.822 Li1 C2 H4 112.822
Li1 C2 H5 112.822 H3 C2 H4 105.922
H3 C2 H5 105.922 H4 C2 H5 105.922

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