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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=

MP3=FULL/6-31G**


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.3156 0.5887 0.0285   0.6249 0.2359 0.0285
C2 -0.3156 -0.5887 0.0285   -0.6249 -0.2359 0.0285
N3 -0.3156 1.8516 -0.1080   1.7944 -0.5551 -0.1080
N4 0.3156 -1.8516 -0.1080   -1.7944 0.5551 -0.1080
H5 1.3974 0.6319 0.0262   0.8092 1.3027 0.0262
H6 -1.3974 -0.6319 0.0262   -0.8092 -1.3027 0.0262
H7 -1.3201 1.7659 -0.0516   1.5781 -1.5397 -0.0516
H8 1.3201 -1.7659 -0.0516   -1.5781 1.5397 -0.0516
H9 -0.0142 2.4941 0.6104   2.4709 -0.3403 0.6104
H10 0.0142 -2.4941 0.6104   -2.4709 0.3403 0.6104
Atom - Atom Distances (Å)
  C1 C2 N3 N4 H5 H6 H7 H8 H9 H10
C1 1.3360 1.4185 2.4441 1.0826 2.1034 2.0169 2.5612 2.0194 3.1517
C2 1.3360 2.4441 1.4185 2.1034 1.0826 2.5612 2.0169 3.1517 2.0194
N3 1.4185 2.4441 3.7567 2.1072 2.7122 1.0097 3.9706 1.0099 4.4171
N4 2.4441 1.4185 3.7567 2.7122 2.1072 3.9706 1.0097 4.4171 1.0099
H5 1.0826 2.1034 2.1072 2.7122 3.0672 2.9456 2.4003 2.4087 3.4679
H6 2.1034 1.0826 2.7122 2.1072 3.0672 2.4003 2.9456 3.4679 2.4087
H7 2.0169 2.5612 1.0097 3.9706 2.9456 2.4003 4.4096 1.6352 4.5130
H8 2.5612 2.0169 3.9706 1.0097 2.4003 2.9456 4.4096 4.5130 1.6352
H9 2.0194 3.1517 1.0099 4.4171 2.4087 3.4679 1.6352 4.5130 4.9884
H10 3.1517 2.0194 4.4171 1.0099 3.4679 2.4087 4.5130 1.6352 4.9884
Maximum atom distance is 4.9884Å 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 125.055 C2 C1 N3 125.055
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 120.484 C1 N3 H7 111.210
C1 N3 H9 111.416 C2 C1 H5 120.484
C2 N4 H8 111.210 C2 N4 H10 111.416
N3 C1 H5 114.141 N4 C2 H6 114.141
H7 N3 H9 108.131 H8 N4 H10 108.131

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