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Geometry for NBr3 (Nitrogen Tribromide) 1A1 C3V

1910171554
InChI=1S/Br3N/c1-4(2)3 INChIKey=UQQALTRHPDPRQC-UHFFFAOYSA-N

wB97X-D/6-311+G(3df,2p)


Point group is C3v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
N1 0.0000 0.0000 0.5987   0.0000 0.0000 0.5987
Br2 0.0000 1.7897 -0.0399   0.0000 1.7897 -0.0399
Br3 1.5499 -0.8948 -0.0399   1.5499 -0.8948 -0.0399
Br4 -1.5499 -0.8948 -0.0399   -1.5499 -0.8948 -0.0399
Atom - Atom Distances (Å)
  N1 Br2 Br3 Br4
N1 1.9002 1.9002 1.9002
Br2 1.9002 3.0998 3.0998
Br3 1.9002 3.0998 3.0998
Br4 1.9002 3.0998 3.0998
Maximum atom distance is 3.0998Å between atoms Br3 and Br4.
picture of Nitrogen Tribromide
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Br2 N1 Br3 109.303 Br2 N1 Br4 109.303
Br3 N1 Br4 109.303

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