Geometry & MOs

Info

ID:	68828
PubChem CID:	46509169
Reduced:	S2O3N4C22H26 (1)
Stoich.:	A2B3C4D22E26 (1)
Weight, g/mol:	403.116821
ΔH_f, kcal/mol:	-60.67
Dipole, Da:	4.75
IP(EA), eV:	-8.78(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[3-(1,3-dioxoisoindol-2-yl)propanoylamino]phenyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3)C4=NC5=CC=CC=C5N4

DOS

IR

Vibrations