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Geometry for C2N2 (Cyanogen) 1Σg D*H

1910171554
InChI=1S/C2N2/c3-1-2-4 INChIKey=JMANVNJQNLATNU-UHFFFAOYSA-N

MP3=FULL/6-31G(2df,p)


Point group is D∞h
Atom Internal
x (Å) y (Å) z (Å)
C1 0.0000 0.0000 0.6903
C2 0.0000 0.0000 -0.6903
N3 0.0000 0.0000 1.8394
N4 0.0000 0.0000 -1.8394
Atom - Atom Distances (Å)
  C1 C2 N3 N4
C1 1.3806 1.1491 2.5297
C2 1.3806 2.5297 1.1491
N3 1.1491 2.5297 3.6788
N4 2.5297 1.1491 3.6788
Maximum atom distance is 3.6788Å between atoms N3 and N4.
picture of Cyanogen
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 N4 180.000 C2 C1 N3 180.000

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