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Geometry for HNC (hydrogen isocyanide) 1Σ C*V

1910171554
InChI=1S/CHN/c1-2/h2H INChIKey=QIUBLANJVAOHHY-UHFFFAOYSA-N

B3LYP/CEP-31G*


Point group is C∞v
Atom Internal
x (Å) y (Å) z (Å)
C1 0.0000 0.0000 -0.8165
N2 0.0000 0.0000 0.3760
H3 0.0000 0.0000 1.3863
Atom - Atom Distances (Å)
  C1 N2 H3
C1 1.1925 2.2029
N2 1.1925 1.0104
H3 2.2029 1.0104
Maximum atom distance is 2.2029Å between atoms C1 and H3.
picture of hydrogen isocyanide
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 N2 H3 180.000

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