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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=

MP4/cc-pVDZ


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.3175 0.5993 0.0308   0.6356 0.2365 0.0308
C2 -0.3175 -0.5993 0.0308   -0.6356 -0.2365 0.0308
N3 -0.3175 1.8713 -0.1186   1.8138 -0.5593 -0.1186
N4 0.3175 -1.8713 -0.1186   -1.8138 0.5593 -0.1186
H5 1.4182 0.6410 0.0289   0.8208 1.3223 0.0289
H6 -1.4182 -0.6410 0.0289   -0.8208 -1.3223 0.0289
H7 -1.3319 1.7616 -0.0220   1.5724 -1.5506 -0.0220
H8 1.3319 -1.7616 -0.0220   -1.5724 1.5506 -0.0220
H9 -0.0233 2.4965 0.6387   2.4720 -0.3493 0.6387
H10 0.0233 -2.4965 0.6387   -2.4720 0.3493 0.6387
Atom - Atom Distances (Å)
  C1 C2 N3 N4 H5 H6 H7 H8 H9 H10
C1 1.3563 1.4296 2.4751 1.1015 2.1332 2.0185 2.5701 2.0212 3.1685
C2 1.3563 2.4751 1.4296 2.1332 1.1015 2.5701 2.0185 3.1685 2.0212
N3 1.4296 2.4751 3.7961 2.1326 2.7468 1.0249 3.9909 1.0252 4.4460
N4 2.4751 1.4296 3.7961 2.7468 2.1326 3.9909 1.0249 4.4460 1.0252
H5 1.1015 2.1332 2.1326 2.7468 3.1126 2.9700 2.4046 2.4275 3.4873
H6 2.1332 1.1015 2.7468 2.1326 3.1126 2.4046 2.9700 3.4873 2.4275
H7 2.0185 2.5701 1.0249 3.9909 2.9700 2.4046 4.4168 1.6399 4.5171
H8 2.5701 2.0185 3.9909 1.0249 2.4046 2.9700 4.4168 4.5171 1.6399
H9 2.0212 3.1685 1.0252 4.4460 2.4275 3.4873 1.6399 4.5171 4.9932
H10 3.1685 2.0212 4.4460 1.0252 3.4873 2.4275 4.5171 1.6399 4.9932
Maximum atom distance is 4.9932Å 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 125.332 C2 C1 N3 125.332
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 120.087 C1 N3 H7 109.543
C1 N3 H9 109.752 C2 C1 H5 120.087
C2 N4 H8 109.543 C2 N4 H10 109.752
N3 C1 H5 114.205 N4 C2 H6 114.205
H7 N3 H9 106.246 H8 N4 H10 106.246

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