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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=

mPW1PW91/6-31+G**


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.3124 0.5924 0.0391   0.5475 0.3856 0.0391
C2 -0.3124 -0.5924 0.0391   -0.5475 -0.3856 0.0391
N3 -0.3124 1.8463 -0.1072   1.8711 -0.0736 -0.1072
N4 0.3124 -1.8463 -0.1072   -1.8711 0.0736 -0.1072
H5 1.3996 0.6385 0.0388   0.4542 1.4697 0.0388
H6 -1.3996 -0.6385 0.0388   -0.4542 -1.4697 0.0388
H7 -1.3220 1.7954 -0.0826   1.9497 -1.0815 -0.0826
H8 1.3220 -1.7954 -0.0826   -1.9497 1.0815 -0.0826
H9 0.0109 2.5350 0.5593   2.5128 0.3350 0.5593
H10 -0.0109 -2.5350 0.5593   -2.5128 -0.3350 0.5593
Atom - Atom Distances (Å)
  C1 C2 N3 N4 H5 H6 H7 H8 H9 H10
C1 1.3394 1.4085 2.4430 1.0882 2.1085 2.0331 2.5953 2.0336 3.1868
C2 1.3394 2.4430 1.4085 2.1085 1.0882 2.5953 2.0331 3.1868 2.0336
N3 1.4085 2.4430 3.7450 2.1002 2.7161 1.0112 3.9917 1.0114 4.4419
N4 2.4430 1.4085 3.7450 2.7161 2.1002 3.9917 1.0112 4.4419 1.0114
H5 1.0882 2.1085 2.1002 2.7161 3.0766 2.9598 2.4381 2.4075 3.5116
H6 2.1085 1.0882 2.7161 2.1002 3.0766 2.4381 2.9598 3.5116 2.4075
H7 2.0331 2.5953 1.0112 3.9917 2.9598 2.4381 4.4592 1.6540 4.5699
H8 2.5953 2.0331 3.9917 1.0112 2.4381 2.9598 4.4592 4.5699 1.6540
H9 2.0336 3.1868 1.0114 4.4419 2.4075 3.5116 1.6540 4.5699 5.0701
H10 3.1868 2.0336 4.4419 1.0114 3.5116 2.4075 4.5699 1.6540 5.0701
Maximum atom distance is 5.0701Å 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 125.489 C2 C1 N3 125.489
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 120.233 C1 N3 H7 113.299
C1 N3 H9 113.332 C2 C1 H5 120.233
C2 N4 H8 113.299 C2 N4 H10 113.332
N3 C1 H5 113.916 N4 C2 H6 113.916
H7 N3 H9 109.716 H8 N4 H10 109.716

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