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Geometry for NH2OH (hydroxylamine) 1A' CS

1910171554
InChI=1S/H3NO/c1-2/h2H,1H2 INChIKey=AVXURJPOCDRRFD-UHFFFAOYSA-N

CCSD(T)/6-31G(2df,p)


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
N1 -0.0121 0.7076 0.0000   0.0014 -0.0120 0.7076
O2 -0.0121 -0.7379 0.0000   0.0014 -0.0120 -0.7379
H3 -0.9526 -0.9297 0.0000   0.1094 -0.9463 -0.9297
H4 0.5669 0.9398 0.8063   0.7358 0.6558 0.9398
H5 0.5669 0.9398 -0.8063   -0.8661 0.4705 0.9398
Atom - Atom Distances (Å)
  N1 O2 H3 H4 H5
N1 1.4454 1.8882 1.0194 1.0194
O2 1.4454 0.9599 1.9493 1.9493
H3 1.8882 0.9599 2.5405 2.5405
H4 1.0194 1.9493 2.5405 1.6126
H5 1.0194 1.9493 2.5405 1.6126
Maximum atom distance is 2.5405Å between atoms H3 and H4.
picture of hydroxylamine
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
N1 O2 H3 101.529 O2 N1 H4 103.166
O2 N1 H5 103.166 H4 N1 H5 104.544

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