Geometry & MOs

Info

ID:	301143
PubChem CID:	123060241
Reduced:	NO7C30H31 (1)
Stoich.:	AB7C30D31 (1)
Weight, g/mol:	521.160515
ΔH_f, kcal/mol:	-188.47
Dipole, Da:	8.7
IP(EA), eV:	-7.94(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-1-(3-chloro-4-methoxyphenyl)-5-(3-ethoxyphenyl)-4-[hydroxy-(3-propoxyphenyl)methylidene]pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCCOC1=CC=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)C3=CC(=C(C=C3)OC)OC)C4=CC(=CC=C4)OCC)/O

DOS

IR

Vibrations