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

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

B2PLYP=FULLultrafine/6-311+G(3df,2p)


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 0.5031   0.0000 0.5031 0.0000
H2 -0.9093 0.0000 1.0992   0.0000 1.0992 -0.9093
H3 0.9093 0.0000 1.0992   0.0000 1.0992 0.9093
F4 0.0000 1.1010 -0.2898   1.1010 -0.2898 0.0000
F5 0.0000 -1.1010 -0.2898   -1.1010 -0.2898 0.0000
Atom - Atom Distances (Å)
  C1 H2 H3 F4 F5
C1 1.0872 1.0872 1.3568 1.3568
H2 1.0872 1.8186 1.9921 1.9921
H3 1.0872 1.8186 1.9921 1.9921
F4 1.3568 1.9921 1.9921 2.2020
F5 1.3568 1.9921 1.9921 2.2020
Maximum atom distance is 2.2020Å 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 108.473
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 C1 H3 113.509 H2 C1 F4 108.687
H2 C1 F5 108.687 H3 C1 F4 108.687
H3 C1 F5 108.687

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