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

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

PBE1PBE/6-31G**


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 0.4958   0.0000 0.4958 0.0000
H2 -0.9090 0.0000 1.1077   0.0000 1.1077 -0.9090
H3 0.9090 0.0000 1.1077   0.0000 1.1077 0.9090
F4 0.0000 1.1015 -0.2883   1.1015 -0.2883 0.0000
F5 0.0000 -1.1015 -0.2883   -1.1015 -0.2883 0.0000
Atom - Atom Distances (Å)
  C1 H2 H3 F4 F5
C1 1.0958 1.0958 1.3521 1.3521
H2 1.0958 1.8181 1.9971 1.9971
H3 1.0958 1.8181 1.9971 1.9971
F4 1.3521 1.9971 1.9971 2.2030
F5 1.3521 1.9971 1.9971 2.2030
Maximum atom distance is 2.2030Å 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 109.108
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 C1 H3 112.111 H2 C1 F4 108.895
H2 C1 F5 108.895 H3 C1 F4 108.895
H3 C1 F5 108.895

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