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Geometry for HCCNH2 (Ethynamine) 1A' CS

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

B97D3/6-31G*


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 -0.1923 1.3627 0.0000   1.3543 0.0000 -0.2446
C2 0.0000 0.1607 0.0000   0.1606 0.0000 -0.0062
N3 0.2257 -1.1794 0.0000   -1.1698 0.0000 0.2709
H4 -0.2126 2.4315 0.0000   2.4215 0.0000 -0.3060
H5 -0.1066 -1.6583 0.8362   -1.6611 0.8362 -0.0427
H6 -0.1066 -1.6583 -0.8362   -1.6611 -0.8362 -0.0427
Atom - Atom Distances (Å)
  C1 C2 N3 H4 H5 H6
C1 1.2172 2.5762 1.0690 3.1357 3.1357
C2 1.2172 1.3590 2.2807 2.0049 2.0049
N3 2.5762 1.3590 3.6374 1.0193 1.0193
H4 1.0690 2.2807 3.6374 4.1757 4.1757
H5 3.1357 2.0049 1.0193 4.1757 1.6725
H6 3.1357 2.0049 1.0193 4.1757 1.6725
Maximum atom distance is 4.1757Å 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 179.533
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C2 C1 H4 171.992 C2 N3 H5 114.153
C2 N3 H6 114.153 H5 N3 H6 110.246

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