Geometry & MOs

Info

ID:

300882

PubChem CID:

123055301

Reduced:

NO7C32H35 (1)

Stoich.:

AB7C32D35 (1)

Weight, g/mol:

543.262088

ΔHf, kcal/mol:

-206.09

Dipole, Da:

7.05

IP(EA), eV:

 -8.67(-1.06)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4E)-1-(2,4-dimethylphenyl)-4-[hydroxy-(4-propan-2-yloxyphenyl)methylidene]-5-[4-methoxy-3-(2-methylpropoxy)phenyl]pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CC(C)COC1=C(C=CC(=C1)C2/C(=C(\C3=CC=C(C=C3)OC(C)C)/O)/C(=O)C(=O)N2C4=CC=CC=C4OC)OC

DOS

IR

Vibrations