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 CO (Carbon monoxide) 1Σ C*V

1910171554
InChI=1S/CO/c1-2 INChIKey=UGFAIRIUMAVXCW-UHFFFAOYSA-N

MP2/6-311G**


Point group is C∞v
Atom Internal
x (Å) y (Å) z (Å)
C1 0.0000 0.0000 -0.6507
O2 0.0000 0.0000 0.4880
Atom - Atom Distances (Å)
  C1 O2
C1 1.1387
O2 1.1387
Maximum atom distance is 1.1387Å between atoms C1 and O2.
picture of Carbon monoxide

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