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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/3-21G*


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.3195 0.5933 0.0353   0.6296 0.2401 0.0353
C2 -0.3195 -0.5933 0.0353   -0.6296 -0.2401 0.0353
N3 -0.3195 1.8792 -0.1002   1.8221 -0.5599 -0.1002
N4 0.3195 -1.8792 -0.1002   -1.8221 0.5599 -0.1002
H5 1.4107 0.6386 0.0413   0.8156 1.3163 0.0413
H6 -1.4107 -0.6386 0.0413   -0.8156 -1.3163 0.0413
H7 -1.3392 1.8201 -0.1578   1.6316 -1.5633 -0.1578
H8 1.3392 -1.8201 -0.1578   -1.6316 1.5633 -0.1578
H9 -0.0273 2.5584 0.6062   2.5334 -0.3579 0.6062
H10 0.0273 -2.5584 0.6062   -2.5334 0.3579 0.6062
Atom - Atom Distances (Å)
  C1 C2 N3 N4 H5 H6 H7 H8 H9 H10
C1 1.3477 1.4423 2.4762 1.0922 2.1239 2.0721 2.6270 2.0755 3.2162
C2 1.3477 2.4762 1.4423 2.1239 1.0922 2.6270 2.0721 3.2162 2.0755
N3 1.4423 2.4762 3.8123 2.1338 2.7477 1.0230 4.0545 1.0226 4.5068
N4 2.4762 1.4423 3.8123 2.7477 2.1338 4.0545 1.0230 4.5068 1.0226
H5 1.0922 2.1239 2.1338 2.7477 3.0970 2.9996 2.4677 2.4643 3.5289
H6 2.1239 1.0922 2.7477 2.1338 3.0970 2.4677 2.9996 3.5289 2.4643
H7 2.0721 2.6270 1.0230 4.0545 2.9996 2.4677 4.5193 1.6882 4.6499
H8 2.6270 2.0721 4.0545 1.0230 2.4677 2.9996 4.5193 4.6499 1.6882
H9 2.0755 3.2162 1.0226 4.5068 2.4643 3.5289 1.6882 4.6499 5.1170
H10 3.2162 2.0755 4.5068 1.0226 3.5289 2.4643 4.6499 1.6882 5.1170
Maximum atom distance is 5.1170Å 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 125.092 C2 C1 N3 125.092
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 120.681 C1 N3 H7 113.290
C1 N3 H9 113.619 C2 C1 H5 120.681
C2 N4 H8 113.290 C2 N4 H10 113.619
N3 C1 H5 113.967 N4 C2 H6 113.967
H7 N3 H9 111.234 H8 N4 H10 111.234

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