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Geometry for CH3F (Methyl fluoride) 1A1 C3V

1910171554
InChI=1S/CH3F/c1-2/h1H3 INChIKey=NBVXSUQYWXRMNV-UHFFFAOYSA-N

B3LYPultrafine/6-31G(2df,p)


Point group is C3v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 -0.6246   -0.6246 0.0000 0.0000
F2 0.0000 0.0000 0.7482   0.7482 0.0000 0.0000
H3 0.0000 1.0315 -0.9956   -0.9956 0.8972 -0.5090
H4 0.8933 -0.5158 -0.9956   -0.9956 -0.0078 1.0315
H5 -0.8933 -0.5158 -0.9956   -0.9956 -0.8894 -0.5225
Atom - Atom Distances (Å)
  C1 F2 H3 H4 H5
C1 1.3728 1.0962 1.0962 1.0962
F2 1.3728 2.0261 2.0261 2.0261
H3 1.0962 2.0261 1.7867 1.7867
H4 1.0962 2.0261 1.7867 1.7867
H5 1.0962 2.0261 1.7867 1.7867
Maximum atom distance is 2.0261Å between atoms F2 and H4.
picture of Methyl fluoride
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
F2 C1 H3 109.781 F2 C1 H4 109.781
F2 C1 H5 109.781 H3 C1 H4 109.160
H3 C1 H5 109.160 H4 C1 H5 109.160

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