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

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

TPSSh/aug-cc-pVTZ


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 0.5083   0.5083 0.0000 0.0000
H2 -0.9151 0.0000 1.1021   1.1021 -0.9151 0.0000
H3 0.9151 0.0000 1.1021   1.1021 0.9151 0.0000
F4 0.0000 1.1067 -0.2919   -0.2919 0.0000 1.1067
F5 0.0000 -1.1067 -0.2919   -0.2919 0.0000 -1.1067
Atom - Atom Distances (Å)
  C1 H2 H3 F4 F5
C1 1.0909 1.0909 1.3656 1.3656
H2 1.0909 1.8302 2.0013 2.0013
H3 1.0909 1.8302 2.0013 2.0013
F4 1.3656 2.0013 2.0013 2.2133
F5 1.3656 2.0013 2.0013 2.2133
Maximum atom distance is 2.2133Å 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 108.265
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 C1 H3 114.040 H2 C1 F4 108.599
H2 C1 F5 108.599 H3 C1 F4 108.599
H3 C1 F5 108.599

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