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Geometry for NH2NO2 (nitramide)

1910171554

MP2/aug-cc-pVDZ


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
N1 0.0867 -1.2584 0.0000   -1.2590 0.0000 0.0766
N2 0.0040 0.1417 0.0000   0.1417 0.0000 0.0051
O3 0.0040 0.6886 1.1031   0.6885 1.1031 0.0095
O4 0.0040 0.6886 -1.1031   0.6885 -1.1031 0.0095
H5 -0.3496 -1.6005 -0.8558   -1.5977 -0.8558 -0.3624
H6 -0.3496 -1.6005 0.8558   -1.5977 0.8558 -0.3624
Atom - Atom Distances (Å)
  N1 N2 O3 O4 H5 H6
N1 1.4025 2.2392 2.2392 1.0197 1.0197
N2 1.4025 1.2312 1.2312 1.9730 1.9730
O3 2.2392 1.2312 2.2062 3.0335 2.3294
O4 2.2392 1.2312 2.2062 2.3294 3.0335
H5 1.0197 1.9730 3.0335 2.3294 1.7116
H6 1.0197 1.9730 2.3294 3.0335 1.7116
Maximum atom distance is 3.0335Å between atoms O3 and H5.
picture of nitramide
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
N1 N2 O3 116.321 N1 N2 O4 116.321
O3 N2 O4 127.259
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
N2 N1 H5 108.043 N2 N1 H6 108.043
H5 N1 H6 114.123

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