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Geometry for CHFCHClz ((Z)-1-Chloro-2-fluoroethene) 1A' CS

1910171554
InChI=1S/C2H2ClF/c3-1-2-4/h1-2H/b2-1- INChIKey=MTKHTBWXSHYCGS-UPHRSURJSA-N

LSDA/6-31G(2df,p)


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.8724 0.0000   0.0858 -0.8682 0.0000
C2 1.2412 0.4032 0.0000   -1.1955 -0.5233 0.0000
Cl3 -1.3541 -0.1611 0.0000   1.3317 0.2935 0.0000
F4 1.5172 -0.8791 0.0000   -1.5963 0.7257 0.0000
H5 -0.2044 1.9435 0.0000   0.3946 -1.9140 0.0000
H6 2.1230 1.0538 0.0000   -2.0091 -1.2575 0.0000
Atom - Atom Distances (Å)
  C1 C2 Cl3 F4 H5 H6
C1 1.3269 1.7035 2.3173 1.0904 2.1307
C2 1.3269 2.6560 1.3117 2.1124 1.0958
Cl3 1.7035 2.6560 2.9597 2.3982 3.6833
F4 2.3173 1.3117 2.9597 3.3062 2.0257
H5 1.0904 2.1124 2.3982 3.3062 2.4917
H6 2.1307 1.0958 3.6833 2.0257 2.4917
Maximum atom distance is 3.6833Å between atoms Cl3 and H6.
picture of (Z)-1-Chloro-2-fluoroethene
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 F4 122.853 C2 C1 Cl3 121.940
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 122.872 C2 C1 H5 121.512
Cl3 C1 H5 116.548 F4 C2 H6 114.274

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