Geometry & MOs

Info

ID:

300943

PubChem CID:

123055439

Reduced:

SCl2N2O6H20C25 (1)

Stoich.:

AB2C2D6E20F25 (1)

Weight, g/mol:

524.090577

ΔHf, kcal/mol:

-157.09

Dipole, Da:

12.27

IP(EA), eV:

 -9.4(-1.24)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[4-[(3E)-2-(3,4-dichlorophenyl)-3-[hydroxy-(2-methoxy-5-methylphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]phenyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)/C(=C\2/C(N(C(=O)C2=O)C3=CC=C(C=C3)S(=O)(=O)N)C4=CC(=C(C=C4)Cl)Cl)/O

DOS

IR

Vibrations