Geometry & MOs

Info

ID:

300907

PubChem CID:

123055355

Reduced:

NO5C32H35 (1)

Stoich.:

AB5C32D35 (1)

Weight, g/mol:

539.191957

ΔHf, kcal/mol:

-149.31

Dipole, Da:

7.28

IP(EA), eV:

 -8.56(-0.98)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCOC1=CC=CC(=C1)C2/C(=C(\C3=CC=C(C=C3)OC(C)C)/O)/C(=O)C(=O)N2C4=CC=C(C=C4)C(C)C

DOS

IR

Vibrations