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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

B3LYP/STO-3G


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
N1 0.0000 0.0000 0.3040   0.3040 0.0000 0.0000
O2 0.0000 0.0000 1.5631   1.5631 0.0000 0.0000
O3 0.0000 0.7988 -0.9146   -0.9146 0.7988 0.0000
O4 0.0000 -0.7988 -0.9146   -0.9146 -0.7988 0.0000
Atom - Atom Distances (Å)
  N1 O2 O3 O4
N1 1.2592 1.4570 1.4570
O2 1.2592 2.6033 2.6033
O3 1.4570 2.6033 1.5975
O4 1.4570 2.6033 1.5975
Maximum atom distance is 2.6033Å 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 146.755 O2 N1 O4 146.755
O3 N1 O4 66.490

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