Geometry & MOs

Info

ID:

301028

PubChem CID:

123059451

Reduced:

ClNO6H28C29 (1)

Stoich.:

ABC6D28E29 (1)

Weight, g/mol:

537.15543

ΔHf, kcal/mol:

-173.03

Dipole, Da:

1.1

IP(EA), eV:

 -8.9(-1.19)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4E)-5-(3-chloro-4-hydroxy-5-methoxyphenyl)-4-[hydroxy-[3-(2-methylpropoxy)phenyl]methylidene]-1-(4-methoxyphenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)N2C(/C(=C(/C3=CC(=CC=C3)OCC(C)C)\O)/C(=O)C2=O)C4=CC(=C(C(=C4)Cl)O)OC

DOS

IR

Vibrations