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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=

MP2/SDD


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.3260 0.6044 0.0574   0.5566 0.4022 0.0574
C2 -0.3260 -0.6044 0.0574   -0.5566 -0.4022 0.0574
N3 -0.3260 1.8823 -0.0980   1.9087 -0.0772 -0.0980
N4 0.3260 -1.8823 -0.0980   -1.9087 0.0772 -0.0980
H5 1.4205 0.6505 0.0592   0.4592 1.4933 0.0592
H6 -1.4205 -0.6505 0.0592   -0.4592 -1.4933 0.0592
H7 -1.3365 1.8586 -0.2301   2.0174 -1.0821 -0.2301
H8 1.3365 -1.8586 -0.2301   -2.0174 1.0821 -0.2301
H9 -0.0078 2.6327 0.5129   2.6111 0.3363 0.5129
H10 0.0078 -2.6327 0.5129   -2.6111 -0.3363 0.5129
Atom - Atom Distances (Å)
  C1 C2 N3 N4 H5 H6 H7 H8 H9 H10
C1 1.3733 1.4430 2.4915 1.0955 2.1505 2.1023 2.6777 2.1055 3.2844
C2 1.3733 2.4915 1.4430 2.1505 1.0955 2.6777 2.1023 3.2844 2.1055
N3 1.4430 2.4915 3.8206 2.1429 2.7636 1.0194 4.0958 1.0186 4.5683
N4 2.4915 1.4430 3.8206 2.7636 2.1429 4.0958 1.0194 4.5683 1.0186
H5 1.0955 2.1505 2.1429 2.7636 3.1246 3.0239 2.5271 2.4849 3.6028
H6 2.1505 1.0955 2.7636 2.1429 3.1246 2.5271 3.0239 3.6028 2.4849
H7 2.1023 2.6777 1.0194 4.0958 3.0239 2.5271 4.5785 1.7078 4.7467
H8 2.6777 2.1023 4.0958 1.0194 2.5271 3.0239 4.5785 4.7467 1.7078
H9 2.1055 3.2844 1.0186 4.5683 2.4849 3.6028 1.7078 4.7467 5.2653
H10 3.2844 2.1055 4.5683 1.0186 3.6028 2.4849 4.7467 1.7078 5.2653
Maximum atom distance is 5.2653Å 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 124.401 C2 C1 N3 124.401
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 120.754 C1 N3 H7 116.187
C1 N3 H9 116.532 C2 C1 H5 120.754
C2 N4 H8 116.187 C2 N4 H10 116.532
N3 C1 H5 114.474 N4 C2 H6 114.474
H7 N3 H9 113.853 H8 N4 H10 113.853

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