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Geometry for CH2F2 (Methane, difluoro-) 1A1 C2V

1910171554
InChI=1S/CH2F2/c2-1-3/h1H2 INChIKey=RWRIWBAIICGTTQ-UHFFFAOYSA-N

PBEPBE/6-31+G**


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 0.5101   0.5101 0.0000 0.0000
H2 -0.9252 0.0000 1.1104   1.1104 -0.9252 0.0000
H3 0.9252 0.0000 1.1104   1.1104 0.9252 0.0000
F4 0.0000 1.1206 -0.2934   -0.2934 0.0000 1.1206
F5 0.0000 -1.1206 -0.2934   -0.2934 0.0000 -1.1206
Atom - Atom Distances (Å)
  C1 H2 H3 F4 F5
C1 1.1029 1.1029 1.3789 1.3789
H2 1.1029 1.8504 2.0205 2.0205
H3 1.1029 1.8504 2.0205 2.0205
F4 1.3789 2.0205 2.0205 2.2413
F5 1.3789 2.0205 2.0205 2.2413
Maximum atom distance is 2.2413Å between atoms F4 and F5.
picture of Methane, difluoro-
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
F4 C1 F5 108.721
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 C1 H3 114.041 H2 C1 F4 108.493
H2 C1 F5 108.493 H3 C1 F4 108.493
H3 C1 F5 108.493

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