Geometry & MOs

Info

ID:	158821
PubChem CID:	56479445
Reduced:	SO2N4C26H30 (1)
Stoich.:	AB2C4D26E30 (1)
Weight, g/mol:	420.067734
ΔH_f, kcal/mol:	-37.93
Dipole, Da:	3.39
IP(EA), eV:	-8.58(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dichlorophenoxy)-N-(1,1-dioxo-4-pyrrolidin-1-ylthiolan-3-yl)propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NC(=CS2)CC(=O)N3CCCC(C3)CNC(=O)NC4=CC=C(C=C4)C

DOS

IR

Vibrations