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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=

B97D3/TZVP


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.3134 0.5941 0.0484   0.5492 0.3868 0.0484
C2 -0.3134 -0.5941 0.0484   -0.5492 -0.3868 0.0484
N3 -0.3134 1.8537 -0.1169   1.8786 -0.0736 -0.1169
N4 0.3134 -1.8537 -0.1169   -1.8786 0.0736 -0.1169
H5 1.4035 0.6405 0.0509   0.4556 1.4739 0.0509
H6 -1.4035 -0.6405 0.0509   -0.4556 -1.4739 0.0509
H7 -1.3263 1.7933 -0.0790   1.9482 -1.0859 -0.0790
H8 1.3263 -1.7933 -0.0790   -1.9482 1.0859 -0.0790
H9 0.0057 2.5447 0.5560   2.5230 0.3312 0.5560
H10 -0.0057 -2.5447 0.5560   -2.5230 -0.3312 0.5560
Atom - Atom Distances (Å)
  C1 C2 N3 N4 H5 H6 H7 H8 H9 H10
C1 1.3434 1.4166 2.4534 1.0911 2.1147 2.0353 2.5965 2.0388 3.1955
C2 1.3434 2.4534 1.4166 2.1147 1.0911 2.5965 2.0353 3.1955 2.0388
N3 1.4166 2.4534 3.7600 2.1089 2.7272 1.0154 3.9988 1.0159 4.4602
N4 2.4534 1.4166 3.7600 2.7272 2.1089 3.9988 1.0154 4.4602 1.0159
H5 1.0911 2.1147 2.1089 2.7272 3.0854 2.9660 2.4384 2.4156 3.5194
H6 2.1147 1.0911 2.7272 2.1089 3.0854 2.4384 2.9660 3.5194 2.4156
H7 2.0353 2.5965 1.0154 3.9988 2.9660 2.4384 4.4608 1.6559 4.5787
H8 2.5965 2.0353 3.9988 1.0154 2.4384 2.9660 4.4608 4.5787 1.6559
H9 2.0388 3.1955 1.0159 4.4602 2.4156 3.5194 1.6559 4.5787 5.0894
H10 3.1955 2.0388 4.4602 1.0159 3.5194 2.4156 4.5787 1.6559 5.0894
Maximum atom distance is 5.0894Å 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 125.457 C2 C1 N3 125.457
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H6 120.242 C1 N3 H7 112.585
C1 N3 H9 112.862 C2 C1 H5 120.242
C2 N4 H8 112.585 C2 N4 H10 112.862
N3 C1 H5 113.862 N4 C2 H6 113.862
H7 N3 H9 109.211 H8 N4 H10 109.211

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