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Geometry for CHClCHCl (Ethene, 1,2-dichloro-, (Z)-) 1A1 C2V

1910171554
InChI=1S/C2H2Cl2/c3-1-2-4/h1-2H/b2-1- INChIKey=KFUSEUYYWQURPO-UPHRSURJSA-N

PBEPBE/3-21G


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.6646 1.0334   1.0334 0.0000 0.6646
C2 0.0000 -0.6646 1.0334   1.0334 0.0000 -0.6646
H3 0.0000 1.2623 1.9436   1.9436 0.0000 1.2623
H4 0.0000 -1.2623 1.9436   1.9436 0.0000 -1.2623
Cl5 0.0000 1.6595 -0.4791   -0.4791 0.0000 1.6595
Cl6 0.0000 -1.6595 -0.4791   -0.4791 0.0000 -1.6595
Atom - Atom Distances (Å)
  C1 C2 H3 H4 Cl5 Cl6
C1 1.3291 1.0889 2.1310 1.8104 2.7729
C2 1.3291 2.1310 1.0889 2.7729 1.8104
H3 1.0889 2.1310 2.5246 2.4550 3.7956
H4 2.1310 1.0889 2.5246 3.7956 2.4550
Cl5 1.8104 2.7729 2.4550 3.7956 3.3190
Cl6 2.7729 1.8104 3.7956 2.4550 3.3190
Maximum atom distance is 3.7956Å between atoms H3 and Cl6.
picture of Ethene, 1,2-dichloro-, (Z)-
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 Cl6 123.339 C2 C1 Cl5 123.339
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H4 123.294 C2 C1 H3 123.294
H3 C1 Cl5 113.367 H4 C2 Cl6 113.367

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