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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=

QCISD/6-31G


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.3217 0.5973 0.0458   0.5500 0.3973 0.0458
C2 -0.3217 -0.5973 0.0458   -0.5500 -0.3973 0.0458
N3 -0.3217 1.8690 -0.0922   1.8951 -0.0739 -0.0922
N4 0.3217 -1.8690 -0.0922   -1.8951 0.0739 -0.0922
H5 1.4164 0.6471 0.0540   0.4558 1.4890 0.0540
H6 -1.4164 -0.6471 0.0540   -0.4558 -1.4890 0.0540
H7 -1.3274 1.8440 -0.2321   2.0021 -1.0742 -0.2321
H8 1.3274 -1.8440 -0.2321   -2.0021 1.0742 -0.2321
H9 -0.0240 2.5971 0.5490   2.5778 0.3167 0.5490
H10 0.0240 -2.5971 0.5490   -2.5778 -0.3167 0.5490
Atom - Atom Distances (Å)
  C1 C2 N3 N4 H5 H6 H7 H8 H9 H10
C1 1.3569 1.4319 2.4702 1.0958 2.1377 2.0859 2.6549 2.0909 3.2475
C2 1.3569 2.4702 1.4319 2.1377 1.0958 2.6549 2.0859 3.2475 2.0909
N3 1.4319 2.4702 3.7930 2.1297 2.7478 1.0156 4.0652 1.0148 4.5251
N4 2.4702 1.4319 3.7930 2.7478 2.1297 4.0652 1.0156 4.5251 1.0148
H5 1.0958 2.1377 2.1297 2.7478 3.1144 3.0071 2.5091 2.4743 3.5649
H6 2.1377 1.0958 2.7478 2.1297 3.1144 2.5091 3.0071 3.5649 2.4743
H7 2.0859 2.6549 1.0156 4.0652 3.0071 2.5091 4.5441 1.6959 4.7074
H8 2.6549 2.0859 4.0652 1.0156 2.5091 3.0071 4.5441 4.7074 1.6959
H9 2.0909 3.2475 1.0148 4.5251 2.4743 3.5649 1.6959 4.7074 5.1944
H10 3.2475 2.0909 4.5251 1.0148 3.5649 2.4743 4.7074 1.6959 5.1944
Maximum atom distance is 5.1944Å 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 124.667 C2 C1 N3 124.667
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 120.912 C1 N3 H7 115.872
C1 N3 H9 116.389 C2 C1 H5 120.912
C2 N4 H8 115.872 C2 N4 H10 116.389
N3 C1 H5 114.160 N4 C2 H6 114.160
H7 N3 H9 113.275 H8 N4 H10 113.275

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