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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

wB97X-D/Def2TZVPP


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.2648 0.7027 0.5059   0.6751 0.5059 0.3289
C2 -0.2648 -0.7027 0.5059   -0.6751 0.5059 -0.3289
F3 -0.2648 1.4276 -0.5423   1.4460 -0.5423 -0.1309
F4 0.2648 -1.4276 -0.5423   -1.4460 -0.5423 0.1309
H5 -0.0163 1.1970 1.4395   1.1933 1.4395 0.0950
H6 1.3517 0.7036 0.4058   0.5749 0.4058 1.4113
H7 0.0163 -1.1970 1.4395   -1.1933 1.4395 -0.0950
H8 -1.3517 -0.7036 0.4058   -0.5749 0.4058 -1.4113
Atom - Atom Distances (Å)
  C1 C2 F3 F4 H5 H6 H7 H8
C1 1.5019 1.3801 2.3743 1.0931 1.0916 2.1312 2.1450
C2 1.5019 2.3743 1.3801 2.1312 2.1450 1.0931 1.0916
F3 1.3801 2.3743 2.9039 2.0106 2.0090 3.3007 2.5734
F4 2.3743 1.3801 2.9039 3.3007 2.5734 2.0106 2.0090
H5 1.0931 2.1312 2.0106 3.3007 1.7842 2.3941 2.5424
H6 1.0916 2.1450 2.0090 2.5734 1.7842 2.5424 3.0478
H7 2.1312 1.0931 3.3007 2.0106 2.3941 2.5424 1.7842
H8 2.1450 1.0916 2.5734 2.0090 2.5424 3.0478 1.7842
Maximum atom distance is 3.3007Å 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 110.868 C2 C1 F3 110.868
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H7 109.417 C1 C2 H8 110.601
C2 C1 H5 109.417 C2 C1 H6 110.601
F3 C1 H5 108.213 F3 C1 H6 108.177
F4 C2 H7 108.213 F4 C2 H8 108.177
H5 C1 H6 109.517 H7 C2 H8 109.517

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