Geometry & MOs

Info

ID:	155521
PubChem CID:	56365857
Reduced:	NO2C12H18 (2)
Stoich.:	AB2C12D18 (2)
Weight, g/mol:	469.217698
ΔH_f, kcal/mol:	-178.05
Dipole, Da:	4.53
IP(EA), eV:	-9.49(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-benzoylpiperidin-4-yl)-1-(3,5-difluorophenyl)-5-oxo-N-propylpyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCCN(C1CCN(CC1)C(=O)C2=CC=CC=C2)C(=O)C(C)OCC3CCCCO3

DOS

IR

Vibrations