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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=

wB97X-D/6-311G*


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.3108 0.5896 0.0355   0.6245 0.2330 0.0355
C2 -0.3108 -0.5896 0.0355   -0.6245 -0.2330 0.0355
N3 -0.3108 1.8492 -0.1081   1.7943 -0.5445 -0.1081
N4 0.3108 -1.8492 -0.1081   -1.7943 0.5445 -0.1081
H5 1.3989 0.6356 0.0341   0.8091 1.3062 0.0341
H6 -1.3989 -0.6356 0.0341   -0.8091 -1.3062 0.0341
H7 -1.3197 1.7869 -0.0755   1.6037 -1.5372 -0.0755
H8 1.3197 -1.7869 -0.0755   -1.6037 1.5372 -0.0755
H9 0.0027 2.5151 0.5854   2.4948 -0.3187 0.5854
H10 -0.0027 -2.5151 0.5854   -2.4948 0.3187 0.5854
Atom - Atom Distances (Å)
  C1 C2 N3 N4 H5 H6 H7 H8 H9 H10
C1 1.3330 1.4120 2.4430 1.0890 2.1034 2.0260 2.5842 2.0260 3.1685
C2 1.3330 2.4430 1.4120 2.1034 1.0890 2.5842 2.0260 3.1685 2.0260
N3 1.4120 2.4430 3.7502 2.1015 2.7163 1.0113 3.9851 1.0113 4.4297
N4 2.4430 1.4120 3.7502 2.7163 2.1015 3.9851 1.0113 4.4297 1.0113
H5 1.0890 2.1034 2.1015 2.7163 3.0730 2.9543 2.4263 2.4053 3.4921
H6 2.1034 1.0890 2.7163 2.1015 3.0730 2.4263 2.9543 3.4921 2.4053
H7 2.0260 2.5842 1.0113 3.9851 2.9543 2.4263 4.4428 1.6479 4.5474
H8 2.5842 2.0260 3.9851 1.0113 2.4263 2.9543 4.4428 4.5474 1.6479
H9 2.0260 3.1685 1.0113 4.4297 2.4053 3.4921 1.6479 4.5474 5.0301
H10 3.1685 2.0260 4.4297 1.0113 3.4921 2.4053 4.5474 1.6479 5.0301
Maximum atom distance is 5.0301Å 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 125.717 C2 C1 N3 125.717
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 120.220 C1 N3 H7 112.397
C1 N3 H9 112.403 C2 C1 H5 120.220
C2 N4 H8 112.397 C2 N4 H10 112.403
N3 C1 H5 113.708 N4 C2 H6 113.708
H7 N3 H9 109.125 H8 N4 H10 109.125

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