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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 F2 (Fluorine diatomic)
1Σg D*H
1910171554
InChI=1S/F2/c1-2 INChIKey=PXGOKWXKJXAPGV-UHFFFAOYSA-N
B3LYP/6-31G
Point group is D∞h
Atom |
Internal |
x (Å) |
y (Å) |
z (Å) |
F1 |
0.0000 |
0.0000 |
0.7339 |
F2 |
0.0000 |
0.0000 |
-0.7339 |
Atom - Atom Distances (Å)
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F1 |
F2 |
F1 |
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1.4678 |
F2 |
1.4678 |
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Maximum atom distance is 1.4678Å
between atoms F1 and F2.
For information on specific bond angles or dihedrals
see the geometry comparison page in section
Comparisons > Geometry > Bonds, angles.