Geometry & MOs

Info

ID:	300972
PubChem CID:	123058772
Reduced:	NO7C32H35 (1)
Stoich.:	AB7C32D35 (1)
Weight, g/mol:	501.215138
ΔH_f, kcal/mol:	-204.5
Dipole, Da:	8.3
IP(EA), eV:	-8.27(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z)-1-(3,5-dimethylphenyl)-5-(4-ethoxy-3-methoxyphenyl)-4-[(3-ethoxyphenyl)-hydroxymethylidene]pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)C2/C(=C(\C3=CC(=CC=C3)OCC)/O)/C(=O)C(=O)N2C4=CC=C(C=C4)OCC(C)C)OC

DOS

IR

Vibrations