Geometry & MOs

Info

ID:	178087
PubChem CID:	76274906
Reduced:	FS2N3O4C20H30 (1)
Stoich.:	AB2C3D4E20F30 (1)
Weight, g/mol:	422.13972
ΔH_f, kcal/mol:	-201.75
Dipole, Da:	5.65
IP(EA), eV:	-8.73(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-(6-methoxynaphthalen-2-yl)propanamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NCC1(CCSC1)N2CCOCC2)NS(=O)(=O)C3=CC=CC=C3F

DOS

IR

Vibrations