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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

BLYP/STO-3G


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 1.8011   1.8011 0.0000 0.0000
C2 0.0000 0.0000 0.4468   0.4468 0.0000 0.0000
H3 0.0000 0.9490 2.3666   2.3666 0.0000 0.9490
H4 0.0000 -0.9490 2.3666   2.3666 0.0000 -0.9490
Cl5 0.0000 1.5328 -0.5359   -0.5359 0.0000 1.5328
Cl6 0.0000 -1.5328 -0.5359   -0.5359 0.0000 -1.5328
Atom - Atom Distances (Å)
  C1 C2 H3 H4 Cl5 Cl6
C1 1.3542 1.1048 1.1048 2.7948 2.7948
C2 1.3542 2.1415 2.1415 1.8208 1.8208
H3 1.1048 2.1415 1.8981 2.9606 3.8189
H4 1.1048 2.1415 1.8981 3.8189 2.9606
Cl5 2.7948 1.8208 2.9606 3.8189 3.0656
Cl6 2.7948 1.8208 3.8189 2.9606 3.0656
Maximum atom distance is 3.8189Å 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 122.665 C1 C2 Cl6 122.665
Cl5 C2 Cl6 114.670
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C2 C1 H3 120.791 C2 C1 H4 120.791
H3 C1 H4 118.418

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