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Geometry for BrONO (Bromine nitrite) 1A' CS trans

1910171554
InChI=1S/BrNO2/c1-4-2-3 INChIKey=ORQUYLREYNLBRU-UHFFFAOYSA-N

mPW1PW91/6-31G*


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Br1 -0.7111 -0.8104 0.0000   -1.0771 0.0480 0.0000
O2 0.0000 0.8901 0.0000   0.6423 -0.6162 0.0000
N3 1.4461 0.8327 0.0000   1.6020 0.4670 0.0000
O4 1.8456 1.9269 0.0000   2.6682 -0.0023 0.0000
Atom - Atom Distances (Å)
  Br1 O2 N3 O4
Br1 1.8432 2.7117 3.7456
O2 1.8432 1.4472 2.1169
N3 2.7117 1.4472 1.1649
O4 3.7456 2.1169 1.1649
Maximum atom distance is 3.7456Å between atoms Br1 and O4.
picture of Bromine nitrite
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Br1 O2 N3 110.420 O2 N3 O4 107.785

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