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Geometry for NH2NO (Nitrosamide) 1A C1

1910171554
InChI=1S/H2N2O/c1-2-3/h(H2,1,3) INChIKey=XKLJHFLUAHKGGU-UHFFFAOYSA-N

mPW1PW91/cc-pVDZ


Point group is C1
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
O1 -1.1145 0.2187 -0.0000   -1.1175 0.2031 0.0000
N2 -0.1450 -0.5028 -0.0000   -0.1379 -0.5047 0.0000
N3 1.0098 0.1450 0.0002   1.0077 0.1591 0.0001
H4 1.0094 1.1658 -0.0003   0.9930 1.1798 -0.0004
H5 1.8533 -0.4109 -0.0005   1.8589 -0.3849 -0.0006
Atom - Atom Distances (Å)
  O1 N2 N3 H4 H5
O1 1.2086 2.1256 2.3255 3.0339
N2 1.2086 1.3240 2.0289 2.0004
N3 2.1256 1.3240 1.0208 1.0102
H4 2.3255 2.0289 1.0208 1.7883
H5 3.0339 2.0004 1.0102 1.7883
Maximum atom distance is 3.0339Å between atoms O1 and H5.
picture of Nitrosamide
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O1 N2 N3 114.057
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
N2 N3 H4 119.265 N2 N3 H5 117.328
H4 N3 H5 123.407

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