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Geometry for CHBrCHBr (Ethene, 1,2-dibromo-, (Z)-) 1A1 C2

1910171554
InChI=1S/C2H2Br2/c3-1-2-4/h1-2H/b2-1- INChIKey=UWTUEMKLYAGTNQ-UPHRSURJSA-N

MP2=FULL/aug-cc-pVDZ


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.6737 1.2558   1.2558 0.0000 0.6737
C2 0.0000 -0.6737 1.2558   1.2558 0.0000 -0.6737
Br3 0.0000 1.7518 -0.2781   -0.2781 0.0000 1.7518
Br4 0.0000 -1.7518 -0.2781   -0.2781 0.0000 -1.7518
H5 0.0000 1.2210 2.2001   2.2001 0.0000 1.2210
H6 0.0000 -1.2210 2.2001   2.2001 0.0000 -1.2210
Atom - Atom Distances (Å)
  C1 C2 Br3 Br4 H5 H6
C1 1.3475 1.8749 2.8699 1.0914 2.1170
C2 1.3475 2.8699 1.8749 2.1170 1.0914
Br3 1.8749 2.8699 3.5036 2.5344 3.8703
Br4 2.8699 1.8749 3.5036 3.8703 2.5344
H5 1.0914 2.1170 2.5344 3.8703 2.4419
H6 2.1170 1.0914 3.8703 2.5344 2.4419
Maximum atom distance is 3.8703Å between atoms Br3 and H6.
picture of Ethene, 1,2-dibromo-, (Z)-
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 Br4 125.100 C2 C1 Br3 125.100
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 120.093 C2 C1 H5 120.093
Br3 C1 H5 114.807 Br4 C2 H6 114.807

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