Geometry & MOs

Info

ID:	301132
PubChem CID:	123059998
Reduced:	ClNO5H28C29 (1)
Stoich.:	ABC5D28E29 (1)
Weight, g/mol:	538.165935
ΔH_f, kcal/mol:	-132.84
Dipole, Da:	4.99
IP(EA), eV:	-8.95(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z)-1-(4-anilinophenyl)-5-(4-chlorophenyl)-4-[hydroxy-(3-propan-2-yloxyphenyl)methylidene]pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCCOC1=CC=CC=C1N2C(/C(=C(\C3=CC(=CC=C3)OC(C)C)/O)/C(=O)C2=O)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations