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Geometry for LiCN (lithium cyanide) 1A' CS

1910171554
InChI=1S/CN.Li/c1-2; INChIKey=KRPAPDCTWMTYHU-UHFFFAOYSA-N

PBEPBE/cc-pVTZ


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Li1 1.4305 -0.5871 0.0000   1.5379 -0.1609 0.0000
C2 -0.7152 -0.3720 0.0000   -0.5817 -0.5583 0.0000
N3 0.0000 0.5705 0.0000   -0.1605 0.5475 0.0000
Atom - Atom Distances (Å)
  Li1 C2 N3
Li1 2.1565 1.8402
C2 2.1565 1.1832
N3 1.8402 1.1832
Maximum atom distance is 2.1565Å between atoms Li1 and C2.
picture of lithium cyanide
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Li1 C2 N3 58.531 Li1 N3 C2 88.212
C2 Li1 N3 33.257

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