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 BeMg (Beryllium Magnesium) 1Σ C*V

1910171554
InChI=1S/Be.Mg INChIKey=UEFUYLGMYTWGJW-UHFFFAOYSA-N

B3LYPultrafine/aug-cc-pVDZ


Point group is C∞v
Atom Internal
x (Å) y (Å) z (Å)
Be1 0.0000 0.0000 -2.3625
Mg2 0.0000 0.0000 0.7875
Atom - Atom Distances (Å)
  Be1 Mg2
Be1 3.1499
Mg2 3.1499
Maximum atom distance is 3.1499Å between atoms Be1 and Mg2.
picture of Beryllium Magnesium

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