return to home page Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
You are here: Home > Geometry > Calculated > Calculated geometry OR Calculated > Geometry > Calculated geometry

Geometry for NO (Nitric oxide) 2Π C*V

1910171554
InChI=1S/NO/c1-2 INChIKey=MWUXSHHQAYIFBG-UHFFFAOYSA-N

B3LYP/CEP-31G*


Point group is C∞v
Atom Internal
x (Å) y (Å) z (Å)
O1 0.0000 0.0000 0.5499
N2 0.0000 0.0000 -0.6285
Atom - Atom Distances (Å)
  O1 N2
O1 1.1784
N2 1.1784
Maximum atom distance is 1.1784Å between atoms O1 and N2.
picture of Nitric oxide

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