Geometry & MOs

Info

ID:	175211
PubChem CID:	75867763
Reduced:	FOSN2H17C19 (1)
Stoich.:	ABCD2E17F19 (1)
Weight, g/mol:	413.21147
ΔH_f, kcal/mol:	-28.01
Dipole, Da:	0.7
IP(EA), eV:	-8.46(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[2-(diethylamino)ethoxy]phenyl]-1-(2-fluorophenyl)-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=CSC3C2C(=O)NC(N3)C4=CC=C(C=C4)F

DOS

IR

Vibrations