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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=

MP2/6-31+G**


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.3175 0.5928 0.0424   0.6291 0.2375 0.0424
C2 -0.3175 -0.5928 0.0424   -0.6291 -0.2375 0.0424
N3 -0.3175 1.8506 -0.1118   1.7935 -0.5559 -0.1118
N4 0.3175 -1.8506 -0.1118   -1.7935 0.5559 -0.1118
H5 1.4015 0.6379 0.0408   0.8150 1.3065 0.0408
H6 -1.4015 -0.6379 0.0408   -0.8150 -1.3065 0.0408
H7 -1.3277 1.7805 -0.0879   1.5924 -1.5484 -0.0879
H8 1.3277 -1.7805 -0.0879   -1.5924 1.5484 -0.0879
H9 -0.0127 2.5285 0.5758   2.5053 -0.3420 0.5758
H10 0.0127 -2.5285 0.5758   -2.5053 0.3420 0.5758
Atom - Atom Distances (Å)
  C1 C2 N3 N4 H5 H6 H7 H8 H9 H10
C1 1.3450 1.4173 2.4483 1.0850 2.1141 2.0333 2.5827 2.0348 3.1812
C2 1.3450 2.4483 1.4173 2.1141 1.0850 2.5827 2.0333 3.1812 2.0348
N3 1.4173 2.4483 3.7553 2.1093 2.7187 1.0130 3.9865 1.0125 4.4450
N4 2.4483 1.4173 3.7553 2.7187 2.1093 3.9865 1.0130 4.4450 1.0125
H5 1.0850 2.1141 2.1093 2.7187 3.0797 2.9616 2.4230 2.4209 3.4987
H6 2.1141 1.0850 2.7187 2.1093 3.0797 2.4230 2.9616 3.4987 2.4209
H7 2.0333 2.5827 1.0130 3.9865 2.9616 2.4230 4.4421 1.6520 4.5612
H8 2.5827 2.0333 3.9865 1.0130 2.4230 2.9616 4.4421 4.5612 1.6520
H9 2.0348 3.1812 1.0125 4.4450 2.4209 3.4987 1.6520 4.5612 5.0570
H10 3.1812 2.0348 4.4450 1.0125 3.4987 2.4209 4.5612 1.6520 5.0570
Maximum atom distance is 5.0570Å 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 124.809 C2 C1 N3 124.809
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 120.547 C1 N3 H7 112.507
C1 N3 H9 112.669 C2 C1 H5 120.547
C2 N4 H8 112.507 C2 N4 H10 112.669
N3 C1 H5 114.242 N4 C2 H6 114.242
H7 N3 H9 109.294 H8 N4 H10 109.294

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