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Geometry for N2H2 ((Z)-Diazene) 1A1 C2V

1910171554
InChI=1S/H2N2/c1-2/h1-2H/b2-1- INChIKey=RAABOESOVLLHRU-UPHRSURJSA-N

B3LYPultrafine/aug-cc-pVDZ


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
N1 0.0000 0.6213 -0.1203   0.6213 -0.1203 0.0000
N2 0.0000 -0.6213 -0.1203   -0.6213 -0.1203 0.0000
H3 0.0000 1.0260 0.8420   1.0260 0.8420 0.0000
H4 0.0000 -1.0260 0.8420   -1.0260 0.8420 0.0000
Atom - Atom Distances (Å)
  N1 N2 H3 H4
N1 1.2425 1.0439 1.9077
N2 1.2425 1.9077 1.0439
H3 1.0439 1.9077 2.0520
H4 1.9077 1.0439 2.0520
Maximum atom distance is 2.0520Å between atoms H3 and H4.
picture of (Z)-Diazene
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 N2 H4 112.813 N2 N1 H3 112.813

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