Geometry & MOs

Info

ID:	268146
PubChem CID:	103598075
Reduced:	ON4H14C17 (1)
Stoich.:	AB4C14D17 (1)
Weight, g/mol:	364.189926
ΔH_f, kcal/mol:	70.63
Dipole, Da:	8.73
IP(EA), eV:	-8.81(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-3-pyridin-2-ylprop-2-enamide

Drug info:

PubChemData

Smile

C1=CC=NC(=C1)C=CC(=O)NC2=CC=C(C=C2)N3C=CN=C3

DOS

IR

Vibrations