Geometry & MOs

Info

ID:

300928

PubChem CID:

123055416

Reduced:

FNCl3O4H17C25 (1)

Stoich.:

ABC3D4E17F25 (1)

Weight, g/mol:

536.988219

ΔHf, kcal/mol:

-135.66

Dipole, Da:

9.33

IP(EA), eV:

 -9.02(-1.13)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4E)-5-(3,4-dichlorophenyl)-1-(3,5-dichlorophenyl)-4-[hydroxy-(2-methoxy-5-methylphenyl)methylidene]pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)/C(=C\2/C(N(C(=O)C2=O)C3=CC(=C(C=C3)F)Cl)C4=CC(=C(C=C4)Cl)Cl)/O

DOS

IR

Vibrations