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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=

HSEh1PBE/6-311G**


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.3105 0.5912 0.0373   0.5468 0.3834 0.0373
C2 -0.3105 -0.5912 0.0373   -0.5468 -0.3834 0.0373
N3 -0.3105 1.8453 -0.1100   1.8698 -0.0726 -0.1100
N4 0.3105 -1.8453 -0.1100   -1.8698 0.0726 -0.1100
H5 1.3987 0.6325 0.0389   0.4489 1.4680 0.0389
H6 -1.3987 -0.6325 0.0389   -0.4489 -1.4680 0.0389
H7 -1.3194 1.7820 -0.0664   1.9357 -1.0813 -0.0664
H8 1.3194 -1.7820 -0.0664   -1.9357 1.0813 -0.0664
H9 0.0090 2.5198 0.5735   2.4981 0.3303 0.5735
H10 -0.0090 -2.5198 0.5735   -2.4981 -0.3303 0.5735
Atom - Atom Distances (Å)
  C1 C2 N3 N4 H5 H6 H7 H8 H9 H10
C1 1.3356 1.4072 2.4409 1.0890 2.1021 2.0213 2.5808 2.0244 3.1730
C2 1.3356 2.4409 1.4072 2.1021 1.0890 2.5808 2.0213 3.1730 2.0244
N3 1.4072 2.4409 3.7425 2.1011 2.7103 1.0118 3.9769 1.0121 4.4286
N4 2.4409 1.4072 3.7425 2.7103 2.1011 3.9769 1.0118 4.4286 1.0121
H5 1.0890 2.1021 2.1011 2.7103 3.0702 2.9531 2.4181 2.4040 3.4935
H6 2.1021 1.0890 2.7103 2.1011 3.0702 2.4181 2.9531 3.4935 2.4040
H7 2.0213 2.5808 1.0118 3.9769 2.9531 2.4181 4.4345 1.6488 4.5423
H8 2.5808 2.0213 3.9769 1.0118 2.4181 2.9531 4.4345 4.5423 1.6488
H9 2.0244 3.1730 1.0121 4.4286 2.4040 3.4935 1.6488 4.5423 5.0397
H10 3.1730 2.0244 4.4286 1.0121 3.4935 2.4040 4.5423 1.6488 5.0397
Maximum atom distance is 5.0397Å 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 125.714 C2 C1 N3 125.714
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 119.885 C1 N3 H7 112.321
C1 N3 H9 112.579 C2 C1 H5 119.885
C2 N4 H8 112.321 C2 N4 H10 112.579
N3 C1 H5 114.041 N4 C2 H6 114.041
H7 N3 H9 109.109 H8 N4 H10 109.109

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