Geometry & MOs

Info

ID:

301063

PubChem CID:

123059695

Reduced:

NO6C33H37 (1)

Stoich.:

AB6C33D37 (1)

Weight, g/mol:

543.262088

ΔHf, kcal/mol:

-188.19

Dipole, Da:

5.92

IP(EA), eV:

 -8.51(-1.01)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4Z)-5-(3,4-diethoxyphenyl)-4-[hydroxy-(3-propan-2-yloxyphenyl)methylidene]-1-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations