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

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

B3LYP/aug-cc-pVDZ


Point group is C∞v
Atom Internal
x (Å) y (Å) z (Å)
C1 0.0000 0.0000 -0.7435
N2 0.0000 0.0000 0.4322
H3 0.0000 0.0000 1.4356
Atom - Atom Distances (Å)
  C1 N2 H3
C1 1.1758 2.1791
N2 1.1758 1.0033
H3 2.1791 1.0033
Maximum atom distance is 2.1791Å 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.