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Geometry for CH2CCl2 (Ethene, 1,1-dichloro-) 1A1 C2V

1910171554
InChI=1S/C2H2Cl2/c1-2(3)4/h1H2 INChIKey=LGXVIGDEPROXKC-UHFFFAOYSA-N

QCISD/6-311G*


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 1.7495   1.7495 0.0000 0.0000
C2 0.0000 0.0000 0.4162   0.4162 0.0000 0.0000
H3 0.0000 0.9349 2.2997   2.2997 0.0000 0.9349
H4 0.0000 -0.9349 2.2997   2.2997 0.0000 -0.9349
Cl5 0.0000 1.4612 -0.5174   -0.5174 0.0000 1.4612
Cl6 0.0000 -1.4612 -0.5174   -0.5174 0.0000 -1.4612
Atom - Atom Distances (Å)
  C1 C2 H3 H4 Cl5 Cl6
C1 1.3333 1.0848 1.0848 2.6970 2.6970
C2 1.3333 2.1028 2.1028 1.7340 1.7340
H3 1.0848 2.1028 1.8698 2.8659 3.6983
H4 1.0848 2.1028 1.8698 3.6983 2.8659
Cl5 2.6970 1.7340 2.8659 3.6983 2.9225
Cl6 2.6970 1.7340 3.6983 2.8659 2.9225
Maximum atom distance is 3.6983Å between atoms H3 and Cl6.
picture of Ethene, 1,1-dichloro-
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 Cl5 122.575 C1 C2 Cl6 122.575
Cl5 C2 Cl6 114.850
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C2 C1 H3 120.478 C2 C1 H4 120.478
H3 C1 H4 119.044

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