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Geometry for HNCCNH (Ethenediimine) 1AG C2H

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

PBEPBEultrafine/cc-pVDZ


Point group is C2h
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.3084 -0.5866 0.0000   -0.6414 0.1670 0.0000
C2 -0.3084 0.5866 0.0000   0.6414 -0.1670 0.0000
N3 0.3084 -1.8469 0.0000   -1.8686 -0.1194 0.0000
N4 -0.3084 1.8469 0.0000   1.8686 0.1194 0.0000
H5 1.2811 -2.2227 0.0000   -2.4557 0.7426 0.0000
H6 -1.2811 2.2227 0.0000   2.4557 -0.7426 0.0000
Atom - Atom Distances (Å)
  C1 C2 N3 N4 H5 H6
C1 1.3255 1.2602 2.5105 1.9034 3.2278
C2 1.3255 2.5105 1.2602 3.2278 1.9034
N3 1.2602 2.5105 3.7449 1.0428 4.3690
N4 2.5105 1.2602 3.7449 4.3690 1.0428
H5 1.9034 3.2278 1.0428 4.3690 5.1310
H6 3.2278 1.9034 4.3690 1.0428 5.1310
Maximum atom distance is 5.1310Å 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 152.272 C2 C1 N3 152.272
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 N3 H5 111.124 C2 N4 H6 111.124

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