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

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

B2PLYP=FULL/6-311G*


Point group is C∞v
Atom Internal
x (Å) y (Å) z (Å)
I1 0.0000 0.0000 0.5194
C2 0.0000 0.0000 -1.4901
N3 0.0000 0.0000 -2.6550
Atom - Atom Distances (Å)
  I1 C2 N3
I1 2.0095 3.1744
C2 2.0095 1.1649
N3 3.1744 1.1649
Maximum atom distance is 3.1744Å 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.