Geometry & MOs

Info

ID:	68981
PubChem CID:	46514703
Reduced:	SN3O4C16H23 (1)
Stoich.:	AB3C4D16E23 (1)
Weight, g/mol:	459.19582
ΔH_f, kcal/mol:	-138.74
Dipole, Da:	1.79
IP(EA), eV:	-9.76(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-benzamidophenyl)ethyl]-1-(2-fluorophenyl)-N-methyl-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCC1NC(=O)C2=CC=CC=C2)S(=O)(=O)N3CCOCC3

DOS

IR

Vibrations