Geometry & MOs

Info

ID:

301033

PubChem CID:

123059487

Reduced:

ClNF3O5H23C28 (1)

Stoich.:

ABC3D5E23F28 (1)

Weight, g/mol:

525.110978

ΔHf, kcal/mol:

-289.21

Dipole, Da:

5.45

IP(EA), eV:

 -9.25(-1.34)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4E)-5-(3-chloro-4-hydroxyphenyl)-1-(5-chloro-2-methylphenyl)-4-[hydroxy-[3-(2-methylpropoxy)phenyl]methylidene]pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CC(C)COC1=CC=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)C3=CC=CC(=C3)C(F)(F)F)C4=CC(=C(C=C4)O)Cl)/O

DOS

IR

Vibrations