Geometry & MOs

Info

ID:

300927

PubChem CID:

123055415

Reduced:

NCl2F2O4H17C25 (1)

Stoich.:

AB2C2D4E17F25 (1)

Weight, g/mol:

519.020719

ΔHf, kcal/mol:

-171.87

Dipole, Da:

9.49

IP(EA), eV:

 -9.07(-1.14)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4E)-1-(3-chloro-4-fluorophenyl)-5-(3,4-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)F)C4=CC(=C(C=C4)Cl)Cl)/O

DOS

IR

Vibrations