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Geometry for C2HF3 (Trifluoroethylene) 1A' CS

1910171554
InChI=1S/C2HF3/c3-1-2(4)5/h1H INChIKey=MIZLGWKEZAPEFJ-UHFFFAOYSA-N

HF/cc-pVTZ


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.4249 0.0000   0.4239 0.0289 0.0000
C2 -0.6881 -0.6813 0.0000   -0.6329 -0.7329 0.0000
F3 1.2873 0.5051 0.0000   0.4162 1.3187 0.0000
F4 -0.5486 1.5977 0.0000   1.6313 -0.4385 0.0000
F5 -0.0850 -1.8541 0.0000   -1.8440 -0.2110 0.0000
H6 -1.7549 -0.6988 0.0000   -0.5777 -1.7984 0.0000
Atom - Atom Distances (Å)
  C1 C2 F3 F4 F5 H6
C1 1.3028 1.2898 1.2947 2.2806 2.0838
C2 1.3028 2.3044 2.2833 1.3188 1.0669
F3 1.2898 2.3044 2.1364 2.7293 3.2717
F4 1.2947 2.2833 2.1364 3.4828 2.5940
F5 2.2806 1.3188 2.7293 3.4828 2.0305
H6 2.0838 1.0669 3.2717 2.5940 2.0305
Maximum atom distance is 3.4828Å between atoms F4 and F5.
picture of Trifluoroethylene
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 F5 120.900 C2 C1 F3 125.447
C2 C1 F4 123.047 F3 C1 F4 111.506
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 122.823 F5 C2 H6 116.277

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