Geometry & MOs

Info

ID:	304105
PubChem CID:	124493586
Reduced:	ON3C11H15 (1)
Stoich.:	AB3C11D15 (1)
Weight, g/mol:	219.137162
ΔH_f, kcal/mol:	-19.41
Dipole, Da:	3.37
IP(EA), eV:	-9.06(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2S)-2-(2-aminopyridin-3-yl)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CCN([C@@H](C1)C2=C(N=CC=C2)N)C=O

DOS

IR

Vibrations