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Geometry for C2HF3 (Trifluoroethylene) 1A' CS

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

B3LYP/CEP-121G


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.4328 0.0000   0.4320 0.0266 0.0000
C2 -0.7362 -0.6893 0.0000   -0.6428 -0.7772 0.0000
F3 1.3708 0.4962 0.0000   0.4110 1.3987 0.0000
F4 -0.5661 1.6911 0.0000   1.7227 -0.4611 0.0000
F5 -0.1119 -1.9369 0.0000   -1.9264 -0.2309 0.0000
H6 -1.8174 -0.7139 0.0000   -0.6008 -1.8579 0.0000
Atom - Atom Distances (Å)
  C1 C2 F3 F4 F5 H6
C1 1.3421 1.3723 1.3798 2.3724 2.1489
C2 1.3421 2.4177 2.3865 1.3950 1.0815
F3 1.3723 2.4177 2.2759 2.8493 3.4102
F4 1.3798 2.3865 2.2759 3.6563 2.7110
F5 2.3724 1.3950 2.8493 3.6563 2.0987
H6 2.1489 1.0815 3.4102 2.7110 2.0987
Maximum atom distance is 3.6563Å 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 120.150 C2 C1 F3 125.917
C2 C1 F4 122.508 F3 C1 F4 111.575
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 124.570 F5 C2 H6 115.280

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