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Geometry for HCCNH2 (Ethynamine) 1A' CS

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

CID/6-31G*


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 -0.0440 1.3657 0.0000   0.0002 -0.0440 1.3657
C2 0.0000 0.1653 0.0000   0.0000 0.0000 0.1653
N3 0.1273 -1.1942 0.0000   -0.0006 0.1273 -1.1942
H4 -0.1167 2.4250 0.0000   0.0006 -0.1167 2.4250
H5 -0.2551 -1.6257 0.8289   0.8302 -0.2509 -1.6257
H6 -0.2551 -1.6257 -0.8289   -0.8276 -0.2593 -1.6257
Atom - Atom Distances (Å)
  C1 C2 N3 H4 H5 H6
C1 1.2013 2.5657 1.0618 3.1113 3.1113
C2 1.2013 1.3654 2.2628 1.9899 1.9899
N3 2.5657 1.3654 3.6275 1.0097 1.0097
H4 1.0618 2.2628 3.6275 4.1370 4.1370
H5 3.1113 1.9899 1.0097 4.1370 1.6579
H6 3.1113 1.9899 1.0097 4.1370 1.6579
Maximum atom distance is 4.1370Å 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 176.751
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C2 C1 H4 178.173 C2 N3 H5 112.966
C2 N3 H6 112.966 H5 N3 H6 110.359

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