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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/6-31G(2df,p)


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.3138 0.5878 0.0236   0.5423 0.3873 0.0236
C2 -0.3138 -0.5878 0.0236   -0.5423 -0.3873 0.0236
N3 -0.3138 1.8540 -0.1068   1.8790 -0.0713 -0.1068
N4 0.3138 -1.8540 -0.1068   -1.8790 0.0713 -0.1068
H5 1.3991 0.6318 0.0241   0.4455 1.4691 0.0241
H6 -1.3991 -0.6318 0.0241   -0.4455 -1.4691 0.0241
H7 -1.3196 1.7714 -0.0338   1.9273 -1.0793 -0.0338
H8 1.3196 -1.7714 -0.0338   -1.9273 1.0793 -0.0338
H9 -0.0043 2.4908 0.6160   2.4704 0.3181 0.6160
H10 0.0043 -2.4908 0.6160   -2.4704 -0.3181 0.6160
Atom - Atom Distances (Å)
  C1 C2 N3 N4 H5 H6 H7 H8 H9 H10
C1 1.3327 1.4192 2.4453 1.0861 2.1028 2.0180 2.5653 2.0182 3.1503
C2 1.3327 2.4453 1.4192 2.1028 1.0861 2.5653 2.0180 3.1503 2.0182
N3 1.4192 2.4453 3.7607 2.1083 2.7155 1.0118 3.9770 1.0118 4.4159
N4 2.4453 1.4192 3.7607 2.7155 2.1083 3.9770 1.0118 4.4159 1.0118
H5 1.0861 2.1028 2.1083 2.7155 3.0702 2.9484 2.4052 2.4032 3.4708
H6 2.1028 1.0861 2.7155 2.1083 3.0702 2.4052 2.9484 3.4708 2.4032
H7 2.0180 2.5653 1.0118 3.9770 2.9484 2.4052 4.4178 1.6340 4.5101
H8 2.5653 2.0180 3.9770 1.0118 2.4052 2.9484 4.4178 4.5101 1.6340
H9 2.0182 3.1503 1.0118 4.4159 2.4032 3.4708 1.6340 4.5101 4.9816
H10 3.1503 2.0182 4.4159 1.0118 3.4708 2.4032 4.5101 1.6340 4.9816
Maximum atom distance is 4.9816Å 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 125.360 C2 C1 N3 125.360
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 120.420 C1 N3 H7 111.112
C1 N3 H9 111.133 C2 C1 H5 120.420
C2 N4 H8 111.112 C2 N4 H10 111.133
N3 C1 H5 113.942 N4 C2 H6 113.942
H7 N3 H9 107.697 H8 N4 H10 107.697

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