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 Na2 (Sodium diatomic) 1Σg D*H

1910171554
InChI=1S/2Na INChIKey=QXNVGIXVLWOKEQ-UHFFFAOYSA-N

PBEPBE/6-311+G(3df,2p)


Point group is D∞h
Atom Internal
x (Å) y (Å) z (Å)
Na1 0.0000 0.0000 1.5383
Na2 0.0000 0.0000 -1.5383
Atom - Atom Distances (Å)
  Na1 Na2
Na1 3.0766
Na2 3.0766
Maximum atom distance is 3.0766Å between atoms Na1 and Na2.
picture of Sodium diatomic

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