Geometry & MOs

Info

ID:

300900

PubChem CID:

123055341

Reduced:

ClNO5C31H32 (1)

Stoich.:

ABC5D31E32 (1)

Weight, g/mol:

535.176165

ΔHf, kcal/mol:

-149.37

Dipole, Da:

8.63

IP(EA), eV:

 -9.01(-0.99)

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-(2-methylpropoxy)phenyl]pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Cl)N2C(/C(=C(/C3=CC=C(C=C3)OC(C)C)\O)/C(=O)C2=O)C4=CC(=CC=C4)OCC(C)C

DOS

IR

Vibrations