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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

PM3


Point group is C2h
Atom Internal
x (Å) y (Å) z (Å)
C1 -0.1504 0.7468 0.0000
C2 0.1504 -0.7468 0.0000
O3 -1.2626 1.2038 0.0000
O4 1.2626 -1.2038 0.0000
Cl5 1.2626 1.7624 0.0000
Cl6 -1.2626 -1.7624 0.0000
Atom - Atom Distances (Å)
  C1 C2 O3 O4 Cl5 Cl6
C1 1.5236 1.2025 2.4086 1.7401 2.7447
C2 1.5236 2.4086 1.2025 2.7447 1.7401
O3 1.2025 2.4086 3.4890 2.5863 2.9662
O4 2.4086 1.2025 3.4890 2.9662 2.5863
Cl5 1.7401 2.7447 2.5863 2.9662 4.3361
Cl6 2.7447 1.7401 2.9662 2.5863 4.3361
Maximum atom distance is 4.3361Å 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 123.719 C1 C2 Cl6 114.321
C2 C1 O3 123.719 C2 C1 Cl5 114.321
O3 C1 Cl5 121.960 O4 C2 Cl6 121.960

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