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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/STO-3G


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.3278 0.5932 0.0103   0.6306 0.2485 0.0103
C2 -0.3278 -0.5932 0.0103   -0.6306 -0.2485 0.0103
N3 -0.3278 1.9084 -0.1238   1.8501 -0.5714 -0.1238
N4 0.3278 -1.9084 -0.1238   -1.8501 0.5714 -0.1238
H5 1.4289 0.6307 0.0005   0.8098 1.3355 0.0005
H6 -1.4289 -0.6307 0.0005   -0.8098 -1.3355 0.0005
H7 -1.3385 1.7618 0.1469   1.5743 -1.5547 0.1469
H8 1.3385 -1.7618 0.1469   -1.5743 1.5547 0.1469
H9 0.0500 2.5121 0.6576   2.4976 -0.2747 0.6576
H10 -0.0500 -2.5121 0.6576   -2.4976 0.2747 0.6576
Atom - Atom Distances (Å)
  C1 C2 N3 N4 H5 H6 H7 H8 H9 H10
C1 1.3555 1.4757 2.5052 1.1017 2.1410 2.0398 2.5663 2.0441 3.1945
C2 1.3555 2.5052 1.4757 2.1410 1.1017 2.5663 2.0398 3.1945 2.0441
N3 1.4757 2.5052 3.8727 2.1758 2.7703 1.0566 4.0398 1.0573 4.4977
N4 2.5052 1.4757 3.8727 2.7703 2.1758 4.0398 1.0566 4.4977 1.0573
H5 1.1017 2.1410 2.1758 2.7703 3.1237 2.9932 2.3986 2.4234 3.5350
H6 2.1410 1.1017 2.7703 2.1758 3.1237 2.3986 2.9932 3.5350 2.4234
H7 2.0398 2.5663 1.0566 4.0398 2.9932 2.3986 4.4251 1.6589 4.4930
H8 2.5663 2.0398 4.0398 1.0566 2.3986 2.9932 4.4251 4.4930 1.6589
H9 2.0441 3.1945 1.0573 4.4977 2.4234 3.5350 1.6589 4.4930 5.0253
H10 3.1945 2.0441 4.4977 1.0573 3.5350 2.4234 4.4930 1.6589 5.0253
Maximum atom distance is 5.0253Å 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 124.412 C2 C1 N3 124.412
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 120.875 C1 N3 H7 106.143
C1 N3 H9 106.436 C2 C1 H5 120.875
C2 N4 H8 106.143 C2 N4 H10 106.436
N3 C1 H5 114.388 N4 C2 H6 114.388
H7 N3 H9 103.396 H8 N4 H10 103.396

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