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Geometry for C2H4F2 (1,2-difluoroethane) 1A C2 gauche

1910171554
InChI=1S/C2H4F2/c3-1-2-4/h1-2H2 INChIKey=AHFMSNDOYCFEPH-UHFFFAOYSA-N

HSEh1PBE/3-21G


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.2790 0.7003 0.5132   0.5367 0.2307 0.7003
C2 -0.2790 -0.7003 0.5132   0.4855 -0.3249 -0.7003
F3 -0.2790 1.4455 -0.5497   -0.5730 -0.2274 1.4455
F4 0.2790 -1.4455 -0.5497   -0.5218 0.3283 -1.4455
H5 0.0382 1.1825 1.4677   1.4650 -0.0967 1.1825
H6 1.3670 0.6507 0.4005   0.5242 1.3245 0.6507
H7 -0.0382 -1.1825 1.4677   1.4580 -0.1727 -1.1825
H8 -1.3670 -0.6507 0.4005   0.2734 -1.3980 -0.6507
Atom - Atom Distances (Å)
  C1 C2 F3 F4 H5 H6 H7 H8
C1 1.5077 1.4130 2.3947 1.0961 1.0949 2.1346 2.1324
C2 1.5077 2.3947 1.4130 2.1346 2.1324 1.0961 1.0949
F3 1.4130 2.3947 2.9444 2.0591 2.0601 3.3218 2.5458
F4 2.3947 1.4130 2.9444 3.3218 2.5458 2.0591 2.0601
H5 1.0961 2.1346 2.0591 3.3218 1.7853 2.3662 2.5444
H6 1.0949 2.1324 2.0601 2.5458 1.7853 2.5444 3.0279
H7 2.1346 1.0961 3.3218 2.0591 2.3662 2.5444 1.7853
H8 2.1324 1.0949 2.5458 2.0601 2.5444 3.0279 1.7853
Maximum atom distance is 3.3218Å between atoms F3 and H7.
picture of 1,2-difluoroethane
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 F4 110.107 C2 C1 F3 110.107
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H7 109.106 C1 C2 H8 109.009
C2 C1 H5 109.106 C2 C1 H6 109.009
F3 C1 H5 109.651 F3 C1 H6 109.803
F4 C2 H7 109.651 F4 C2 H8 109.803
H5 C1 H6 109.143 H7 C2 H8 109.143

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