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Geometry for CCl2O (Phosgene) 1A1 C2V

1910171554
InChI=1S/CCl2O/c2-1(3)4 INChIKey=YGYAWVDWMABLBF-UHFFFAOYSA-N

MP2/3-21G*


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
O1 0.0000 0.0000 1.7309   1.7309 0.0000 0.0000
C2 0.0000 0.0000 0.5195   0.5195 0.0000 0.0000
Cl3 0.0000 1.4564 -0.4989   -0.4989 0.0000 1.4564
Cl4 0.0000 -1.4564 -0.4989   -0.4989 0.0000 -1.4564
Atom - Atom Distances (Å)
  O1 C2 Cl3 Cl4
O1 1.2114 2.6633 2.6633
C2 1.2114 1.7772 1.7772
Cl3 2.6633 1.7772 2.9129
Cl4 2.6633 1.7772 2.9129
Maximum atom distance is 2.9129Å between atoms Cl3 and Cl4.
picture of Phosgene
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O1 C2 Cl3 124.964 O1 C2 Cl4 124.964
Cl3 C2 Cl4 110.072

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