Geometry & MOs

Info

ID:	170653
PubChem CID:	75263576
Reduced:	N2O3C13H16 (2)
Stoich.:	A2B3C13D16 (2)
Weight, g/mol:	477.097915
ΔH_f, kcal/mol:	-207.36
Dipole, Da:	1.39
IP(EA), eV:	-9.24(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[2-(2-chlorophenyl)-3-[hydroxy-(4-methoxyphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]phenyl]acetic acid

Drug info:

PubChemData

Smile

CC1=CC=CC=C1OCC(=O)OCC(=O)N(CC(C)C)C2C(N(C(=O)NC2=O)CC3=CC=CC=C3)N

DOS

IR

Vibrations