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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=

QCISD(T)/6-311G*


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.3166 0.5953 0.0381   0.5493 0.3909 0.0381
C2 -0.3166 -0.5953 0.0381   -0.5493 -0.3909 0.0381
N3 -0.3166 1.8631 -0.1145   1.8884 -0.0729 -0.1145
N4 0.3166 -1.8631 -0.1145   -1.8884 0.0729 -0.1145
H5 1.4090 0.6413 0.0337   0.4537 1.4801 0.0337
H6 -1.4090 -0.6413 0.0337   -0.4537 -1.4801 0.0337
H7 -1.3266 1.7724 -0.0633   1.9291 -1.0862 -0.0633
H8 1.3266 -1.7724 -0.0633   -1.9291 1.0862 -0.0633
H9 -0.0124 2.5143 0.6024   2.4948 0.3129 0.6024
H10 0.0124 -2.5143 0.6024   -2.4948 -0.3129 0.6024
Atom - Atom Distances (Å)
  C1 C2 N3 N4 H5 H6 H7 H8 H9 H10
C1 1.3484 1.4253 2.4631 1.0934 2.1229 2.0238 2.5761 2.0271 3.1749
C2 1.3484 2.4631 1.4253 2.1229 1.0934 2.5761 2.0238 3.1749 2.0271
N3 1.4253 2.4631 3.7796 2.1195 2.7363 1.0154 3.9899 1.0152 4.4479
N4 2.4631 1.4253 3.7796 2.7363 2.1195 3.9899 1.0154 4.4479 1.0152
H5 1.0934 2.1229 2.1195 2.7363 3.0962 2.9618 2.4171 2.4191 3.4974
H6 2.1229 1.0934 2.7363 2.1195 3.0962 2.4171 2.9618 3.4974 2.4191
H7 2.0238 2.5761 1.0154 3.9899 2.9618 2.4171 4.4278 1.6494 4.5400
H8 2.5761 2.0238 3.9899 1.0154 2.4171 2.9618 4.4278 4.5400 1.6494
H9 2.0271 3.1749 1.0152 4.4479 2.4191 3.4974 1.6494 4.5400 5.0286
H10 3.1749 2.0271 4.4479 1.0152 3.4974 2.4191 4.5400 1.6494 5.0286
Maximum atom distance is 5.0286Å 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 125.225 C2 C1 N3 125.225
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 120.419 C1 N3 H7 110.916
C1 N3 H9 111.213 C2 C1 H5 120.419
C2 N4 H8 110.916 C2 N4 H10 111.213
N3 C1 H5 113.947 N4 C2 H6 113.947
H7 N3 H9 108.640 H8 N4 H10 108.640

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