Geometry & MOs

Info

ID:

300884

PubChem CID:

123055304

Reduced:

NO3C16H16 (2)

Stoich.:

AB3C16D16 (2)

Weight, g/mol:

543.262088

ΔHf, kcal/mol:

-139.1

Dipole, Da:

10.74

IP(EA), eV:

 -8.61(-1.27)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations