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Geometry for ClCOClCO (Oxalyl chloride) 1AG C2H

1910171554
InChI=1S/C2Cl2O2/c3-1(5)2(4)6 INChIKey=CTSLXHKWHWQRSH-UHFFFAOYSA-N

HF/3-21G*


Point group is C2h
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 -0.1616 0.7468 0.0000   0.7261 0.2381 0.0000
C2 0.1616 -0.7468 0.0000   -0.7261 -0.2381 0.0000
O3 -1.2673 1.1752 0.0000   1.6546 -0.4994 0.0000
O4 1.2673 -1.1752 0.0000   -1.6546 0.4994 0.0000
Cl5 1.2673 1.7364 0.0000   0.8576 1.9712 0.0000
Cl6 -1.2673 -1.7364 0.0000   -0.8576 -1.9712 0.0000
Atom - Atom Distances (Å)
  C1 C2 O3 O4 Cl5 Cl6
C1 1.5282 1.1858 2.3949 1.7381 2.7182
C2 1.5282 2.3949 1.1858 2.7182 1.7381
O3 1.1858 2.3949 3.4566 2.5959 2.9116
O4 2.3949 1.1858 3.4566 2.9116 2.5959
Cl5 1.7381 2.7182 2.5959 2.9116 4.2993
Cl6 2.7182 1.7381 2.9116 2.5959 4.2993
Maximum atom distance is 4.2993Å between atoms Cl5 and Cl6.
picture of Oxalyl chloride
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 O4 123.385 C1 C2 Cl6 112.496
C2 C1 O3 123.385 C2 C1 Cl5 112.496
O3 C1 Cl5 124.118 O4 C2 Cl6 124.118

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