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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=

MP2=FULL/6-31G**


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.3155 0.5917 0.0357   0.5456 0.3899 0.0357
C2 -0.3155 -0.5917 0.0357   -0.5456 -0.3899 0.0357
N3 -0.3155 1.8494 -0.1124   1.8748 -0.0720 -0.1124
N4 0.3155 -1.8494 -0.1124   -1.8748 0.0720 -0.1124
H5 1.3986 0.6338 0.0351   0.4463 1.4693 0.0351
H6 -1.3986 -0.6338 0.0351   -0.4463 -1.4693 0.0351
H7 -1.3225 1.7633 -0.0623   1.9205 -1.0817 -0.0623
H8 1.3225 -1.7633 -0.0623   -1.9205 1.0817 -0.0623
H9 -0.0181 2.5031 0.6004   2.4842 0.3080 0.6004
H10 0.0181 -2.5031 0.6004   -2.4842 -0.3080 0.6004
Atom - Atom Distances (Å)
  C1 C2 N3 N4 H5 H6 H7 H8 H9 H10
C1 1.3411 1.4149 2.4456 1.0840 2.1072 2.0162 2.5631 2.0208 3.1600
C2 1.3411 2.4456 1.4149 2.1072 1.0840 2.5631 2.0162 3.1600 2.0208
N3 1.4149 2.4456 3.7523 2.1066 2.7132 1.0119 3.9670 1.0119 4.4231
N4 2.4456 1.4149 3.7523 2.7132 2.1066 3.9670 1.0119 4.4231 1.0119
H5 1.0840 2.1072 2.1066 2.7132 3.0711 2.9478 2.4003 2.4126 3.4736
H6 2.1072 1.0840 2.7132 2.1066 3.0711 2.4003 2.9478 3.4736 2.4126
H7 2.0162 2.5631 1.0119 3.9670 2.9478 2.4003 4.4082 1.6395 4.5209
H8 2.5631 2.0162 3.9670 1.0119 2.4003 2.9478 4.4082 4.5209 1.6395
H9 2.0208 3.1600 1.0119 4.4231 2.4126 3.4736 1.6395 4.5209 5.0064
H10 3.1600 2.0208 4.4231 1.0119 3.4736 2.4126 4.5209 1.6395 5.0064
Maximum atom distance is 5.0064Å 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 125.068 C2 C1 N3 125.068
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 120.293 C1 N3 H7 111.282
C1 N3 H9 111.680 C2 C1 H5 120.293
C2 N4 H8 111.282 C2 N4 H10 111.680
N3 C1 H5 114.270 N4 C2 H6 114.270
H7 N3 H9 108.215 H8 N4 H10 108.215

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