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Geometry for NBr3 (Nitrogen Tribromide) 1A1 C3V

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

B3PW91/cc-pVTZ


Point group is C3v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
N1 0.0000 0.0000 0.6230   0.0000 0.0000 0.6230
Br2 0.0000 1.8038 -0.0415   1.8038 0.0000 -0.0415
Br3 1.5621 -0.9019 -0.0415   -0.9019 1.5621 -0.0415
Br4 -1.5621 -0.9019 -0.0415   -0.9019 -1.5621 -0.0415
Atom - Atom Distances (Å)
  N1 Br2 Br3 Br4
N1 1.9223 1.9223 1.9223
Br2 1.9223 3.1242 3.1242
Br3 1.9223 3.1242 3.1242
Br4 1.9223 3.1242 3.1242
Maximum atom distance is 3.1242Å 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 108.708 Br2 N1 Br4 108.708
Br3 N1 Br4 108.708

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