Geometry & MOs

Info

ID:	26346
PubChem CID:	645244
Reduced:	ON2C7H8 (3)
Stoich.:	AB2C7D8 (3)
Weight, g/mol:	425.147452
ΔH_f, kcal/mol:	-16.65
Dipole, Da:	4.57
IP(EA), eV:	-8.61(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCC(=O)NC1=CC=CC=C1C2=NN(N=N2)CC(=O)NC3=CC=C(C=C3)OCC

DOS

IR

Vibrations