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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=

HF/6-31G


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.3132 0.5843 0.0346   0.6199 0.2350 0.0346
C2 -0.3132 -0.5843 0.0346   -0.6199 -0.2350 0.0346
N3 -0.3132 1.8361 -0.0629   1.7803 -0.5479 -0.0629
N4 0.3132 -1.8361 -0.0629   -1.7803 0.5479 -0.0629
H5 1.3878 0.6254 0.0473   0.7995 1.2953 0.0473
H6 -1.3878 -0.6254 0.0473   -0.7995 -1.2953 0.0473
H7 -1.2791 1.8801 -0.2823   1.6989 -1.5114 -0.2823
H8 1.2791 -1.8801 -0.2823   -1.6989 1.5114 -0.2823
H9 0.0449 2.5924 0.4682   2.5765 -0.2906 0.4682
H10 -0.0449 -2.5924 0.4682   -2.5765 0.2906 0.4682
Atom - Atom Distances (Å)
  C1 C2 N3 N4 H5 H6 H7 H8 H9 H10
C1 1.3258 1.4032 2.4224 1.0755 2.0872 2.0772 2.6658 2.0719 3.2261
C2 1.3258 2.4224 1.4032 2.0872 1.0755 2.6658 2.0772 3.2261 2.0719
N3 1.4032 2.4224 3.7253 2.0908 2.6881 0.9915 4.0489 0.9911 4.4684
N4 2.4224 1.4032 3.7253 2.6881 2.0908 4.0489 0.9915 4.4684 0.9911
H5 1.0755 2.0872 2.0908 2.6881 3.0443 2.9657 2.5294 2.4186 3.5473
H6 2.0872 1.0755 2.6881 2.0908 3.0443 2.5294 2.9657 3.5473 2.4186
H7 2.0772 2.6658 0.9915 4.0489 2.9657 2.5294 4.5479 1.6804 4.7000
H8 2.6658 2.0772 4.0489 0.9915 2.5294 2.9657 4.5479 4.7000 1.6804
H9 2.0719 3.2261 0.9911 4.4684 2.4186 3.5473 1.6804 4.7000 5.1856
H10 3.2261 2.0719 4.4684 0.9911 3.5473 2.4186 4.7000 1.6804 5.1856
Maximum atom distance is 5.1856Å 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 125.133 C2 C1 N3 125.133
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 120.376 C1 N3 H7 119.324
C1 N3 H9 118.834 C2 C1 H5 120.376
C2 N4 H8 119.324 C2 N4 H10 118.834
N3 C1 H5 114.378 N4 C2 H6 114.378
H7 N3 H9 115.894 H8 N4 H10 115.894

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