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Geometry for ClCN (chlorocyanogen) 1Σ C*V

1910171554
InChI=1S/CClN/c2-1-3 INChIKey=QPJDMGCKMHUXFD-UHFFFAOYSA-N

BLYP/cc-pVDZ


Point group is C∞v
Atom Internal
x (Å) y (Å) z (Å)
Cl1 0.0000 0.0000 0.9953
C2 0.0000 0.0000 -0.6668
N3 0.0000 0.0000 -1.8455
Atom - Atom Distances (Å)
  Cl1 C2 N3
Cl1 1.6620 2.8408
C2 1.6620 1.1788
N3 2.8408 1.1788
Maximum atom distance is 2.8408Å between atoms Cl1 and N3.
picture of chlorocyanogen
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Cl1 C2 N3 180.000

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