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Geometry for NH3O (Ammonia Oxide) 1A1 C3V

1910171554
InChI=1S/H3NO/c1-2/h1H3 INChIKey=GSWAOPJLTADLTN-UHFFFAOYSA-N

B3LYP/aug-cc-pVDZ


Point group is C3v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
N1 0.0000 0.0000 -0.5405   -0.5405 0.0000 0.0000
O2 0.0000 0.0000 0.8244   0.8244 0.0000 0.0000
H3 0.0000 0.9562 -0.9374   -0.9374 0.9562 0.0000
H4 0.8281 -0.4781 -0.9374   -0.9374 -0.4781 0.8281
H5 -0.8281 -0.4781 -0.9374   -0.9374 -0.4781 -0.8281
Atom - Atom Distances (Å)
  N1 O2 H3 H4 H5
N1 1.3649 1.0354 1.0354 1.0354
O2 1.3649 2.0046 2.0046 2.0046
H3 1.0354 2.0046 1.6563 1.6563
H4 1.0354 2.0046 1.6563 1.6563
H5 1.0354 2.0046 1.6563 1.6563
Maximum atom distance is 2.0046Å between atoms O2 and H3.
picture of Ammonia Oxide
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
O2 N1 H3 112.543 O2 N1 H4 112.543
O2 N1 H5 112.543 H3 N1 H4 106.232
H3 N1 H5 106.232 H4 N1 H5 106.232

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