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 GaN (Gallium mononitride) 3Π C*V

1910171554
InChI=1S/Ga.N INChIKey=JMASRVWKEDWRBT-UHFFFAOYSA-N

BLYP/STO-3G


Point group is C∞v
Atom Internal
x (Å) y (Å) z (Å)
Ga1 0.0000 0.0000 0.2616
N2 0.0000 0.0000 -1.1583
Atom - Atom Distances (Å)
  Ga1 N2
Ga1 1.4199
N2 1.4199
Maximum atom distance is 1.4199Å between atoms Ga1 and N2.
picture of Gallium mononitride

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