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Geometry for BrCN (Cyanogen bromide) 1Σ C*V

1910171554
InChI=1S/CBrN/c2-1-3 INChIKey=ATDGTVJJHBUTRL-UHFFFAOYSA-N

PBEPBE/aug-cc-pVTZ


Point group is C∞v
Atom Internal
x (Å) y (Å) z (Å)
C1 0.0000 0.0000 -1.1373
N2 0.0000 0.0000 -2.3050
Br3 0.0000 0.0000 0.6560
Atom - Atom Distances (Å)
  C1 N2 Br3
C1 1.1678 1.7932
N2 1.1678 2.9610
Br3 1.7932 2.9610
Maximum atom distance is 2.9610Å between atoms N2 and Br3.
picture of Cyanogen bromide
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
N2 C1 Br3 180.000

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