Geometry & MOs

Info

ID:

301013

PubChem CID:

123059341

Reduced:

NO7C31H33 (1)

Stoich.:

AB7C31D33 (1)

Weight, g/mol:

543.262088

ΔHf, kcal/mol:

-201.54

Dipole, Da:

5.6

IP(EA), eV:

 -8.46(-1.11)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4Z)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy-[3-(2-methylpropoxy)phenyl]methylidene]-1-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations