Geometry & MOs

Info

ID:	129601
PubChem CID:	51073249
Reduced:	N3O3C19H25 (1)
Stoich.:	A3B3C19D25 (1)
Weight, g/mol:	316.189926
ΔH_f, kcal/mol:	-105.54
Dipole, Da:	6.45
IP(EA), eV:	-8.72(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-acetylpiperidin-4-yl)-2-pyrrolidin-1-ylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)NC3CCN(CC3)C(=O)C

DOS

IR

Vibrations