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Geometry for (nitrogen trioxide cation) 1A1 C2V

1910171554
InChI=1S/NO3/c2-1(3)4/q+1 INChIKey=MGUAMNYNQZUFET-UHFFFAOYSA-N

wB97X-D/6-31G*


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
N1 0.0000 0.0000 0.2449   0.2449 0.0000 0.0000
O2 0.0000 0.0000 1.3785   1.3785 0.0000 0.0000
O3 0.0000 0.7789 -0.7964   -0.7964 0.7789 0.0000
O4 0.0000 -0.7789 -0.7964   -0.7964 -0.7789 0.0000
Atom - Atom Distances (Å)
  N1 O2 O3 O4
N1 1.1336 1.3003 1.3003
O2 1.1336 2.3101 2.3101
O3 1.3003 2.3101 1.5578
O4 1.3003 2.3101 1.5578
Maximum atom distance is 2.3101Å between atoms O2 and O3.
picture of nitrogen trioxide cation
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O2 N1 O3 143.201 O2 N1 O4 143.201
O3 N1 O4 73.598

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