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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=

B1B95/6-311G**


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.3104 0.5896 0.0365   0.6242 0.2330 0.0365
C2 -0.3104 -0.5896 0.0365   -0.6242 -0.2330 0.0365
N3 -0.3104 1.8430 -0.1096   1.7886 -0.5419 -0.1096
N4 0.3104 -1.8430 -0.1096   -1.7886 0.5419 -0.1096
H5 1.3957 0.6307 0.0373   0.8028 1.3044 0.0373
H6 -1.3957 -0.6307 0.0373   -0.8028 -1.3044 0.0373
H7 -1.3174 1.7788 -0.0638   1.5972 -1.5326 -0.0638
H8 1.3174 -1.7788 -0.0638   -1.5972 1.5326 -0.0638
H9 0.0084 2.5147 0.5745   2.4954 -0.3109 0.5745
H10 -0.0084 -2.5147 0.5745   -2.4954 0.3109 0.5745
Atom - Atom Distances (Å)
  C1 C2 N3 N4 H5 H6 H7 H8 H9 H10
C1 1.3326 1.4063 2.4369 1.0861 2.0976 2.0184 2.5756 2.0215 3.1666
C2 1.3326 2.4369 1.4063 2.0976 1.0861 2.5756 2.0184 3.1666 2.0215
N3 1.4063 2.4369 3.7378 2.0981 2.7053 1.0101 3.9710 1.0103 4.4213
N4 2.4369 1.4063 3.7378 2.7053 2.0981 3.9710 1.0101 4.4213 1.0103
H5 1.0861 2.0976 2.0981 2.7053 3.0632 2.9478 2.4129 2.4005 3.4862
H6 2.0976 1.0861 2.7053 2.0981 3.0632 2.4129 2.9478 3.4862 2.4005
H7 2.0184 2.5756 1.0101 3.9710 2.9478 2.4129 4.4270 1.6452 4.5338
H8 2.5756 2.0184 3.9710 1.0101 2.4129 2.9478 4.4270 4.5338 1.6452
H9 2.0215 3.1666 1.0103 4.4213 2.4005 3.4862 1.6452 4.5338 5.0294
H10 3.1666 2.0215 4.4213 1.0103 3.4862 2.4005 4.5338 1.6452 5.0294
Maximum atom distance is 5.0294Å 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 125.663 C2 C1 N3 125.663
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 119.932 C1 N3 H7 112.260
C1 N3 H9 112.516 C2 C1 H5 119.932
C2 N4 H8 112.260 C2 N4 H10 112.516
N3 C1 H5 114.048 N4 C2 H6 114.048
H7 N3 H9 109.037 H8 N4 H10 109.037

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