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Geometry for HCCNH2 (Ethynamine) 1A' CS

1910171554
InChI=1S/C2H3N/c1-2-3/h1H,3H2 INChIKey=

B1B95/aug-cc-pVDZ


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 -0.0058 1.3681 0.0000   -0.0002 -0.0058 1.3681
C2 0.0000 0.1573 0.0000   0.0000 0.0000 0.1573
N3 0.0853 -1.1886 0.0000   0.0023 0.0853 -1.1886
H4 -0.0260 2.4343 0.0000   -0.0007 -0.0260 2.4343
H5 -0.2682 -1.6334 0.8360   0.8285 -0.2905 -1.6334
H6 -0.2682 -1.6334 -0.8360   -0.8429 -0.2457 -1.6334
Atom - Atom Distances (Å)
  C1 C2 N3 H4 H5 H6
C1 1.2108 2.5584 1.0663 3.1269 3.1269
C2 1.2108 1.3486 2.2771 1.9944 1.9944
N3 2.5584 1.3486 3.6246 1.0108 1.0108
H4 1.0663 2.2771 3.6246 4.1598 4.1598
H5 3.1269 1.9944 1.0108 4.1598 1.6720
H6 3.1269 1.9944 1.0108 4.1598 1.6720
Maximum atom distance is 4.1598Å between atoms H4 and H5.
picture of Ethynamine
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 N3 176.648
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C2 C1 H4 179.189 C2 N3 H5 114.650
C2 N3 H6 114.650 H5 N3 H6 111.596

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