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Geometry for CH3F (Methyl fluoride) 1A1 C3V

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

G3B3
This model chemistry uses a geometry from B3LYP/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 -0.6303   -0.6303 0.0000 0.0000
F2 0.0000 0.0000 0.7530   0.7530 0.0000 0.0000
H3 0.0000 1.0328 -0.9982   -0.9982 0.6197 0.8262
H4 0.8944 -0.5164 -0.9982   -0.9982 0.4057 -0.9498
H5 -0.8944 -0.5164 -0.9982   -0.9982 -1.0254 0.1235
Atom - Atom Distances (Å)
  C1 F2 H3 H4 H5
C1 1.3833 1.0964 1.0964 1.0964
F2 1.3833 2.0330 2.0330 2.0330
H3 1.0964 2.0330 1.7889 1.7889
H4 1.0964 2.0330 1.7889 1.7889
H5 1.0964 2.0330 1.7889 1.7889
Maximum atom distance is 2.0330Å 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 109.613 F2 C1 H4 109.613
F2 C1 H5 109.613 H3 C1 H4 109.329
H3 C1 H5 109.329 H4 C1 H5 109.329

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