Geometry & MOs

Info

ID:	300704
PubChem CID:	123050938
Reduced:	SN2O6H26C27 (1)
Stoich.:	AB2C6D26E27 (1)
Weight, g/mol:	484.199822
ΔH_f, kcal/mol:	-156.02
Dipole, Da:	9.0
IP(EA), eV:	-9.41(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(4Z)-4-[hydroxy-(4-methylphenyl)methylidene]-2,3-dioxo-5-(3-propoxyphenyl)pyrrolidin-1-yl]phenyl]acetamide

Drug info:

PubChemData

Smile

CCCOC1=CC=CC(=C1)C2/C(=C(/C3=CC=C(C=C3)C)\O)/C(=O)C(=O)N2C4=CC=C(C=C4)S(=O)(=O)N

DOS

IR

Vibrations