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Geometry for CH2BrCH2Br (Ethane, 1,2-dibromo-) 1Ag C2H

1910171554
InChI=1S/C2H4Br2/c3-1-2-4/h1-2H2 INChIKey=PAAZPARNPHGIKF-UHFFFAOYSA-N

B1B95/3-21G


Point group is C2h
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.4996 0.5686 0.0000   0.6586 0.3730 0.0000
C2 -0.4996 -0.5686 0.0000   -0.6586 -0.3730 0.0000
Br3 -0.4996 2.2453 0.0000   2.0961 -0.9474 0.0000
Br4 0.4996 -2.2453 0.0000   -2.0961 0.9474 0.0000
H5 1.1182 0.5581 0.8939   0.7746 0.9807 0.8939
H6 1.1182 0.5581 -0.8939   0.7746 0.9807 -0.8939
H7 -1.1182 -0.5581 0.8939   -0.7746 -0.9807 0.8939
H8 -1.1182 -0.5581 -0.8939   -0.7746 -0.9807 -0.8939
Atom - Atom Distances (Å)
  C1 C2 Br3 Br4 H5 H6 H7 H8
C1 1.5138 1.9518 2.8140 1.0872 1.0872 2.1647 2.1647
C2 1.5138 2.8140 1.9518 2.1647 2.1647 1.0872 1.0872
Br3 1.9518 2.8140 4.6005 2.5026 2.5026 3.0068 3.0068
Br4 2.8140 1.9518 4.6005 3.0068 3.0068 2.5026 2.5026
H5 1.0872 2.1647 2.5026 3.0068 1.7879 2.4995 3.0731
H6 1.0872 2.1647 2.5026 3.0068 1.7879 3.0731 2.4995
H7 2.1647 1.0872 3.0068 2.5026 2.4995 3.0731 1.7879
H8 2.1647 1.0872 3.0068 2.5026 3.0731 2.4995 1.7879
Maximum atom distance is 4.6005Å between atoms Br3 and Br4.
picture of Ethane, 1,2-dibromo-
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 Br4 107.908 C2 C1 Br3 107.908
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H7 111.610 C1 C2 H8 111.610
C2 C1 H5 111.610 C2 C1 H6 111.610
Br3 C1 H5 107.434 Br3 C1 H6 107.434
Br4 C2 H7 107.434 Br4 C2 H8 107.434
H5 C1 H6 110.623 H7 C2 H8 110.623

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