Geometry & MOs

Info

ID:	72929
PubChem CID:	48416694
Reduced:	SO3N4C18H22 (1)
Stoich.:	AB3C4D18E22 (1)
Weight, g/mol:	388.191069
ΔH_f, kcal/mol:	-76.81
Dipole, Da:	4.36
IP(EA), eV:	-8.98(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[1-(2-fluoro-4-methylphenyl)-5-oxopyrrolidine-3-carbonyl]piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

CC1=CC=C(O1)C2=NC(=CS2)CC(=O)N3CCCC(C3)N4CCNC4=O

DOS

IR

Vibrations