Geometry & MOs

Info

ID:	300960
PubChem CID:	123058746
Reduced:	N2O3H28C32 (1)
Stoich.:	A2B3C28D32 (1)
Weight, g/mol:	529.246438
ΔH_f, kcal/mol:	-9.55
Dipole, Da:	7.44
IP(EA), eV:	-8.28(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z)-5-(4-butoxyphenyl)-4-[(3-ethoxyphenyl)-hydroxymethylidene]-1-(2-propoxyphenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)C2/C(=C(\C3=CC=CC=C3)/O)/C(=O)C(=O)N2C4=CC=C(C=C4)NC5=CC=CC=C5

DOS

IR

Vibrations