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Geometry for ICN (Cyanogen iodide) 1Σ C*V

1910171554
InChI=1S/CIN/c2-1-3 INChIKey=WPBXOELOQKLBDF-UHFFFAOYSA-N

PBE1PBE/STO-3G


Point group is C∞v
Atom Internal
x (Å) y (Å) z (Å)
I1 0.0000 0.0000 0.5193
C2 0.0000 0.0000 -1.4737
N3 0.0000 0.0000 -2.6689
Atom - Atom Distances (Å)
  I1 C2 N3
I1 1.9930 3.1882
C2 1.9930 1.1952
N3 3.1882 1.1952
Maximum atom distance is 3.1882Å between atoms I1 and N3.
picture of Cyanogen iodide
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
I1 C2 N3 180.000

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