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 NaH (sodium hydride) 1Σ C*V

1910171554
InChI=1S/Na.H INChIKey=MPMYQQHEHYDOCL-UHFFFAOYSA-N

LSDA/6-31G(2df,p)


Point group is C∞v
Atom Internal
x (Å) y (Å) z (Å)
Na1 0.0000 0.0000 0.1557
H2 0.0000 0.0000 -1.7123
Atom - Atom Distances (Å)
  Na1 H2
Na1 1.8679
H2 1.8679
Maximum atom distance is 1.8679Å between atoms Na1 and H2.
picture of sodium hydride

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