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Geometry for CNN (Diazocarbene) 3Σ- C*V

1910171554
InChI=1S/CN2/c1-3-2 INChIKey=QDZARNQKIZUXDK-UHFFFAOYSA-N

QCISD(T)=FULL/aug-cc-pVDZ


Point group is C∞v
Atom Internal
x (Å) y (Å) z (Å)
C1 0.0000 0.0000 -1.3057
N2 0.0000 0.0000 -0.0543
N3 0.0000 0.0000 1.1734
Atom - Atom Distances (Å)
  C1 N2 N3
C1 1.2514 2.4791
N2 1.2514 1.2277
N3 2.4791 1.2277
Maximum atom distance is 2.4791Å between atoms C1 and N3.
picture of Diazocarbene
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 N2 N3 180.000

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