Geometry & MOs

Info

ID:	300962
PubChem CID:	123058751
Reduced:	ClNO5C30H30 (1)
Stoich.:	ABC5D30E30 (1)
Weight, g/mol:	521.160515
ΔH_f, kcal/mol:	-137.52
Dipole, Da:	9.46
IP(EA), eV:	-9.06(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-5-(4-butoxyphenyl)-1-(5-chloro-2-hydroxyphenyl)-4-[(3-ethoxyphenyl)-hydroxymethylidene]pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCCCOC1=CC=C(C=C1)C2/C(=C(/C3=CC(=CC=C3)OCC)\O)/C(=O)C(=O)N2C4=C(C=C(C=C4)Cl)C

DOS

IR

Vibrations