Geometry & MOs

Info

ID:

300948

PubChem CID:

123055447

Reduced:

NCl3O5H18C25 (1)

Stoich.:

AB3C5D18E25 (1)

Weight, g/mol:

495.100414

ΔHf, kcal/mol:

-131.63

Dipole, Da:

8.08

IP(EA), eV:

 -8.82(-1.13)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4E)-5-(3,4-dichlorophenyl)-1-(2,4-dimethylphenyl)-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=C(C=CC(=C3)Cl)O)C4=CC(=C(C=C4)Cl)Cl)/O

DOS

IR

Vibrations