Geometry & MOs

Info

ID:	68821
PubChem CID:	46509155
Reduced:	OS2N4C24H24 (1)
Stoich.:	AB2C4D24E24 (1)
Weight, g/mol:	423.098584
ΔH_f, kcal/mol:	52.08
Dipole, Da:	4.68
IP(EA), eV:	-8.83(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-chlorophenyl)-N-[4-(furan-2-carbonylamino)phenyl]-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CSC(=N1)SCC2=CC=C(C=C2)C(=O)N3CCCC(C3)C4=NC5=CC=CC=C5N4

DOS

IR

Vibrations