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Geometry for SCN (thiocyanato radical) 2Π C*V

1910171554
InChI=1S/CNS/c2-1-3 INChIKey=NYAZXHASVIWIRJ-UHFFFAOYSA-N

TPSSh/6-31G*


Point group is C∞v
Atom Internal
x (Å) y (Å) z (Å)
C1 0.0000 0.0000 -0.6274
S2 0.0000 0.0000 1.0264
N3 0.0000 0.0000 -1.8082
Atom - Atom Distances (Å)
  C1 S2 N3
C1 1.6537 1.1809
S2 1.6537 2.8346
N3 1.1809 2.8346
Maximum atom distance is 2.8346Å between atoms S2 and N3.
picture of thiocyanato radical
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
S2 C1 N3 180.000

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