Geometry & MOs

Info

ID:

301109

PubChem CID:

123059901

Reduced:

ClNO5H24C30 (1)

Stoich.:

ABC5D24E30 (1)

Weight, g/mol:

511.095328

ΔHf, kcal/mol:

-104.09

Dipole, Da:

7.81

IP(EA), eV:

 -8.74(-0.98)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)OC1=CC=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)C3=CC=CC4=CC=CC=C43)C5=CC(=C(C=C5)O)Cl)/O

DOS

IR

Vibrations