Geometry & MOs

Info

ID:

300888

PubChem CID:

123055315

Reduced:

NO7C32H35 (1)

Stoich.:

AB7C32D35 (1)

Weight, g/mol:

503.210801

ΔHf, kcal/mol:

-207.2

Dipole, Da:

6.86

IP(EA), eV:

 -7.92(-0.91)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4E)-1-(3-fluorophenyl)-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)OC

DOS

IR

Vibrations