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Geometry for NH3NH3 (Ammonia Dimer)

1910171554

MP2_cp/6-31+G**


Point group is C2h
Atom Internal
x (Å) y (Å) z (Å)
H1 0.6837 0.8249 0.0000
N2 0.0000 1.5740 0.0000
N3 0.0000 -1.5740 0.0000
H4 0.1625 2.1498 0.8168
H5 0.1625 2.1498 -0.8168
H6 -0.6837 -0.8249 0.0000
H7 -0.1625 -2.1498 -0.8168
H8 -0.1625 -2.1498 0.8168
Atom - Atom Distances (Å)
  H1 N2 N3 H4 H5 H6 H7 H8
H1 1.0142 2.4944 1.6414 1.6414 2.1429 3.1988 3.1988
N2 1.0142 3.1479 1.0125 1.0125 2.4944 3.8157 3.8157
N3 2.4944 3.1479 3.8157 3.8157 1.0142 1.0125 1.0125
H4 1.6414 1.0125 3.8157 1.6336 3.1988 4.6109 4.3118
H5 1.6414 1.0125 3.8157 1.6336 3.1988 4.3118 4.6109
H6 2.1429 2.4944 1.0142 3.1988 3.1988 1.6414 1.6414
H7 3.1988 3.8157 1.0125 4.6109 4.3118 1.6414 1.6336
H8 3.1988 3.8157 1.0125 4.3118 4.6109 1.6414 1.6336
Maximum atom distance is 4.6109Å between atoms H4 and H7.
picture of Ammonia Dimer
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

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