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Geometry for HNCCNH (Ethenediimine) 1AG C2H

1910171554
InChI=1S/C2H2N2/c3-1-2-4/h3-4H INChIKey=RUTRGUOJQDNDCQ-UHFFFAOYSA-N

QCISD/6-31G


Point group is C2h
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.3101 -0.5880 0.0000   -0.6426 0.1700 0.0000
C2 -0.3101 0.5880 0.0000   0.6426 -0.1700 0.0000
N3 0.3101 -1.8626 0.0000   -1.8846 -0.1167 0.0000
N4 -0.3101 1.8626 0.0000   1.8846 0.1167 0.0000
H5 1.2447 -2.3028 0.0000   -2.5237 0.6950 0.0000
H6 -1.2447 2.3028 0.0000   2.5237 -0.6950 0.0000
Atom - Atom Distances (Å)
  C1 C2 N3 N4 H5 H6
C1 1.3295 1.2746 2.5278 1.9529 3.2823
C2 1.3295 2.5278 1.2746 3.2823 1.9529
N3 1.2746 2.5278 3.7764 1.0330 4.4460
N4 2.5278 1.2746 3.7764 4.4460 1.0330
H5 1.9529 3.2823 1.0330 4.4460 5.2352
H6 3.2823 1.9529 4.4460 1.0330 5.2352
Maximum atom distance is 5.2352Å between atoms H5 and H6.
picture of Ethenediimine
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 N4 152.189 C2 C1 N3 152.189
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 N3 H5 115.222 C2 N4 H6 115.222

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