Geometry & MOs

Info

ID:

300938

PubChem CID:

123055429

Reduced:

NCl2F3O4H18C26 (1)

Stoich.:

AB2C3D4E18F26 (1)

Weight, g/mol:

497.079678

ΔHf, kcal/mol:

-242.91

Dipole, Da:

7.9

IP(EA), eV:

 -9.19(-1.11)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4E)-5-(3,4-dichlorophenyl)-4-[hydroxy-(2-methoxy-5-methylphenyl)methylidene]-1-(4-methoxyphenyl)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=CC(=C3)C(F)(F)F)C4=CC(=C(C=C4)Cl)Cl)/O

DOS

IR

Vibrations