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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 MgF (Magnesium monofluoride)
2Σ C*V
1910171554
InChI=1S/FH.Mg/h1H;/q;+1/p-1 INChIKey=WSXHQDSJUJYQDO-UHFFFAOYSA-M
BLYP/6-31G**
Point group is C∞v
Atom |
Internal |
x (Å) |
y (Å) |
z (Å) |
Mg1 |
0.0000 |
0.0000 |
0.7576 |
F2 |
0.0000 |
0.0000 |
-1.0102 |
Atom - Atom Distances (Å)
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Mg1 |
F2 |
Mg1 |
| 1.7678 |
F2 |
1.7678 |
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Maximum atom distance is 1.7678Å
between atoms Mg1 and F2.
For information on specific bond angles or dihedrals
see the geometry comparison page in section
Comparisons > Geometry > Bonds, angles.