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 MgF (Magnesium monofluoride) 2Σ C*V

1910171554
InChI=1S/FH.Mg/h1H;/q;+1/p-1 INChIKey=WSXHQDSJUJYQDO-UHFFFAOYSA-M

B3LYPultrafine/aug-cc-pVTZ


Point group is C∞v
Atom Internal
x (Å) y (Å) z (Å)
Mg1 0.0000 0.0000 0.7548
F2 0.0000 0.0000 -1.0063
Atom - Atom Distances (Å)
  Mg1 F2
Mg1 1.7611
F2 1.7611
Maximum atom distance is 1.7611Å between atoms Mg1 and F2.
picture of Magnesium monofluoride

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