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 BrF (Bromine monofluoride) 1Σ C*V

1910171554
InChI=1S/BrF/c1-2 INChIKey=MZJUGRUTVANEDW-UHFFFAOYSA-N

mPW1PW91/cc-pVTZ


Point group is C∞v
Atom Internal
x (Å) y (Å) z (Å)
Br1 0.0000 0.0000 0.3589
F2 0.0000 0.0000 -1.3959
Atom - Atom Distances (Å)
  Br1 F2
Br1 1.7548
F2 1.7548
Maximum atom distance is 1.7548Å between atoms Br1 and F2.
picture of Bromine monofluoride

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