Geometry & MOs

Info

ID:

301027

PubChem CID:

123059449

Reduced:

ClFNO6H25C28 (1)

Stoich.:

ABCD6E25F28 (1)

Weight, g/mol:

521.160515

ΔHf, kcal/mol:

-209.37

Dipole, Da:

6.93

IP(EA), eV:

 -8.88(-1.29)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4E)-5-(3-chloro-4-hydroxy-5-methoxyphenyl)-4-[hydroxy-[3-(2-methylpropoxy)phenyl]methylidene]-1-(3-methylphenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CC(C)COC1=CC=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)C3=CC=C(C=C3)F)C4=CC(=C(C(=C4)Cl)O)OC)/O

DOS

IR

Vibrations