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Geometry for BrF3 (Bromine trifluoride) 1A1 C2V

1910171554
InChI=1S/BrF3/c2-1(3)4 INChIKey=FQFKTKUFHWNTBN-UHFFFAOYSA-N

HF/6-31G(2df,p)


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Br1 0.0000 0.0000 0.2893   0.2893 0.0000 0.0000
F2 0.0000 0.0000 -1.3741   -1.3741 0.0000 0.0000
F3 0.0000 1.7450 0.1245   0.1245 0.0000 1.7450
F4 0.0000 -1.7450 0.1245   0.1245 0.0000 -1.7450
Atom - Atom Distances (Å)
  Br1 F2 F3 F4
Br1 1.6635 1.7528 1.7528
F2 1.6635 2.3002 2.3002
F3 1.7528 2.3002 3.4900
F4 1.7528 2.3002 3.4900
Maximum atom distance is 3.4900Å between atoms F3 and F4.
picture of Bromine trifluoride
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
F2 Br1 F3 84.606 F2 Br1 F4 84.606
F3 Br1 F4 169.212

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