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Geometry for CH2CF2 (Ethene, 1,1-difluoro-) 1A1 C2V

1910171554
InChI=1S/C2H2F2/c1-2(3)4/h1H2 INChIKey=BQCIDUSAKPWEOX-UHFFFAOYSA-N

B3PW91/6-31G*


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 1.3843   1.3843 0.0000 0.0000
C2 0.0000 0.0000 0.0625   0.0625 0.0000 0.0000
H3 0.0000 0.9376 1.9232   1.9232 0.9376 0.0000
H4 0.0000 -0.9376 1.9232   1.9232 -0.9376 0.0000
F5 0.0000 1.0824 -0.6959   -0.6959 1.0824 0.0000
F6 0.0000 -1.0824 -0.6959   -0.6959 -1.0824 0.0000
Atom - Atom Distances (Å)
  C1 C2 H3 H4 F5 F6
C1 1.3218 1.0815 1.0815 2.3450 2.3450
C2 1.3218 2.0836 2.0836 1.3217 1.3217
H3 1.0815 2.0836 1.8753 2.6232 3.3077
H4 1.0815 2.0836 1.8753 3.3077 2.6232
F5 2.3450 1.3217 2.6232 3.3077 2.1649
F6 2.3450 1.3217 3.3077 2.6232 2.1649
Maximum atom distance is 3.3077Å between atoms H3 and F6.
picture of Ethene, 1,1-difluoro-
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 F5 125.017 C1 C2 F6 125.017
F5 C2 F6 109.966
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C2 C1 H3 119.891 C2 C1 H4 119.891
H3 C1 H4 120.218

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