Geometry & MOs

Info

ID:

300577

PubChem CID:

123043651

Reduced:

NO6H23C27 (1)

Stoich.:

AB6C23D27 (1)

Weight, g/mol:

451.074199

ΔHf, kcal/mol:

-158.85

Dipole, Da:

4.63

IP(EA), eV:

-9.24(-1.39)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCOC(=O)C1=CC=C(C=C1)N2C(/C(=C(/C3=CC=CC=C3)\O)/C(=O)C2=O)C4=CC(=CC=C4)O

DOS

IR

Vibrations