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Geometry for NBr3 (Nitrogen Tribromide) 1A1 C3V

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

B3LYP/CEP-31G


Point group is C3v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
N1 0.0000 0.0000 0.6492   0.0000 0.0000 0.6492
Br2 0.0000 1.9255 -0.0433   0.0000 1.9255 -0.0433
Br3 1.6675 -0.9628 -0.0433   1.6675 -0.9628 -0.0433
Br4 -1.6675 -0.9628 -0.0433   -1.6675 -0.9628 -0.0433
Atom - Atom Distances (Å)
  N1 Br2 Br3 Br4
N1 2.0463 2.0463 2.0463
Br2 2.0463 3.3351 3.3351
Br3 2.0463 3.3351 3.3351
Br4 2.0463 3.3351 3.3351
Maximum atom distance is 3.3351Å between atoms Br2 and Br3.
picture of Nitrogen Tribromide
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Br2 N1 Br3 109.160 Br2 N1 Br4 109.160
Br3 N1 Br4 109.160

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