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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=

CCD/6-311G*


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.3147 0.5913 0.0319   0.5456 0.3886 0.0319
C2 -0.3147 -0.5913 0.0319   -0.5456 -0.3886 0.0319
N3 -0.3147 1.8585 -0.1089   1.8836 -0.0714 -0.1089
N4 0.3147 -1.8585 -0.1089   -1.8836 0.0714 -0.1089
H5 1.4049 0.6368 0.0279   0.4496 1.4755 0.0279
H6 -1.4049 -0.6368 0.0279   -0.4496 -1.4755 0.0279
H7 -1.3228 1.7739 -0.0692   1.9303 -1.0820 -0.0692
H8 1.3228 -1.7739 -0.0692   -1.9303 1.0820 -0.0692
H9 -0.0142 2.5024 0.6122   2.4832 0.3099 0.6122
H10 0.0142 -2.5024 0.6122   -2.4832 -0.3099 0.6122
Atom - Atom Distances (Å)
  C1 C2 N3 N4 H5 H6 H7 H8 H9 H10
C1 1.3397 1.4219 2.4538 1.0911 2.1131 2.0224 2.5731 2.0242 3.1620
C2 1.3397 2.4538 1.4219 2.1131 1.0911 2.5731 2.0224 3.1620 2.0242
N3 1.4219 2.4538 3.7699 2.1138 2.7265 1.0124 3.9847 1.0124 4.4323
N4 2.4538 1.4219 3.7699 2.7265 2.1138 3.9847 1.0124 4.4323 1.0124
H5 1.0911 2.1131 2.1138 2.7265 3.0849 2.9568 2.4141 2.4157 3.4828
H6 2.1131 1.0911 2.7265 2.1138 3.0849 2.4141 2.9568 3.4828 2.4157
H7 2.0224 2.5731 1.0124 3.9847 2.9568 2.4141 4.4257 1.6454 4.5320
H8 2.5731 2.0224 3.9847 1.0124 2.4141 2.9568 4.4257 4.5320 1.6454
H9 2.0242 3.1620 1.0124 4.4323 2.4157 3.4828 1.6454 4.5320 5.0049
H10 3.1620 2.0242 4.4323 1.0124 3.4828 2.4157 4.5320 1.6454 5.0049
Maximum atom distance is 5.0049Å 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 125.362 C2 C1 N3 125.362
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 120.413 C1 N3 H7 111.253
C1 N3 H9 111.403 C2 C1 H5 120.413
C2 N4 H8 111.253 C2 N4 H10 111.403
N3 C1 H5 113.876 N4 C2 H6 113.876
H7 N3 H9 108.709 H8 N4 H10 108.709

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