return to home page Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Geometry for NaH (sodium hydride) 1Σ C*V

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

B2PLYP=FULLultrafine/6-31G*


Point group is C∞v
Atom Internal
x (Å) y (Å) z (Å)
Na1 0.0000 0.0000 0.1578
H2 0.0000 0.0000 -1.7353
Atom - Atom Distances (Å)
  Na1 H2
Na1 1.8931
H2 1.8931
Maximum atom distance is 1.8931Å 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.