Geometry & MOs

Info

ID:

300895

PubChem CID:

123055330

Reduced:

NO5C32H35 (1)

Stoich.:

AB5C32D35 (1)

Weight, g/mol:

519.181251

ΔHf, kcal/mol:

-150.03

Dipole, Da:

8.12

IP(EA), eV:

 -8.76(-0.85)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)N2C(/C(=C(/C3=CC=C(C=C3)OC(C)C)\O)/C(=O)C2=O)C4=CC(=CC=C4)OCC(C)C

DOS

IR

Vibrations