Geometry & MOs

Info

ID:

300898

PubChem CID:

123055336

Reduced:

NO6C33H37 (1)

Stoich.:

AB6C33D37 (1)

Weight, g/mol:

533.196901

ΔHf, kcal/mol:

-191.45

Dipole, Da:

10.19

IP(EA), eV:

 -8.14(-0.96)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)COC1=CC=CC(=C1)C2/C(=C(\C3=CC=C(C=C3)OC(C)C)/O)/C(=O)C(=O)N2C4=CC=C(C=C4)OC(C)C

DOS

IR

Vibrations