Geometry & MOs

Info

ID:

300908

PubChem CID:

123055373

Reduced:

NF3O5H28C30 (1)

Stoich.:

AB3C5D28E30 (1)

Weight, g/mol:

521.160515

ΔHf, kcal/mol:

-290.42

Dipole, Da:

5.77

IP(EA), eV:

 -9.17(-1.16)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4E)-1-(5-chloro-2-hydroxyphenyl)-4-[hydroxy-(4-propan-2-yloxyphenyl)methylidene]-5-(3-propoxyphenyl)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=CC(=C4)C(F)(F)F

DOS

IR

Vibrations