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Geometry for H2NCHCHNH2 (diaminoethylene) 1A C2

1910171554
InChI=1S/C2H6N2/c3-1-2-4/h1-2H,3-4H2/b2-1+ INChIKey=

TPSSh/Def2TZVPP


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.3129 0.5908 0.0410   0.6260 0.2347 0.0410
C2 -0.3129 -0.5908 0.0410   -0.6260 -0.2347 0.0410
N3 -0.3129 1.8496 -0.1137   1.7943 -0.5472 -0.1137
N4 0.3129 -1.8496 -0.1137   -1.7943 0.5472 -0.1137
H5 1.3987 0.6374 0.0422   0.8112 1.3055 0.0422
H6 -1.3987 -0.6374 0.0422   -0.8112 -1.3055 0.0422
H7 -1.3224 1.7896 -0.0488   1.6055 -1.5407 -0.0488
H8 1.3224 -1.7896 -0.0488   -1.6055 1.5407 -0.0488
H9 0.0185 2.5337 0.5569   2.5152 -0.3061 0.5569
H10 -0.0185 -2.5337 0.5569   -2.5152 0.3061 0.5569
Atom - Atom Distances (Å)
  C1 C2 N3 N4 H5 H6 H7 H8 H9 H10
C1 1.3371 1.4143 2.4453 1.0867 2.1066 2.0297 2.5871 2.0317 3.1841
C2 1.3371 2.4453 1.4143 2.1066 1.0867 2.5871 2.0297 3.1841 2.0317
N3 1.4143 2.4453 3.7518 2.1032 2.7181 1.0134 3.9903 1.0137 4.4440
N4 2.4453 1.4143 3.7518 2.7181 2.1032 3.9903 1.0134 4.4440 1.0137
H5 1.0867 2.1066 2.1032 2.7181 3.0741 2.9564 2.4298 2.4012 3.5112
H6 2.1066 1.0867 2.7181 2.1032 3.0741 2.4298 2.9564 3.5112 2.4012
H7 2.0297 2.5871 1.0134 3.9903 2.9564 2.4298 4.4504 1.6489 4.5561
H8 2.5871 2.0297 3.9903 1.0134 2.4298 2.9564 4.4504 4.5561 1.6489
H9 2.0317 3.1841 1.0137 4.4440 2.4012 3.5112 1.6489 4.5561 5.0675
H10 3.1841 2.0317 4.4440 1.0137 3.5112 2.4012 4.5561 1.6489 5.0675
Maximum atom distance is 5.0675Å between atoms H9 and H10.
picture of diaminoethylene
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 N4 125.408 C2 C1 N3 125.408
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 120.367 C1 N3 H7 112.403
C1 N3 H9 112.554 C2 C1 H5 120.367
C2 N4 H8 112.403 C2 N4 H10 112.554
N3 C1 H5 113.834 N4 C2 H6 113.834
H7 N3 H9 108.865 H8 N4 H10 108.865

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