Geometry & MOs

Info

ID:

87199

PubChem CID:

49893018

Reduced:

NCl2S2O5H17C24 (1)

Stoich.:

AB2C2D5E17F24 (1)

Weight, g/mol:

558.041913

ΔHf, kcal/mol:

-136.71

Dipole, Da:

10.97

IP(EA), eV:

 -9.17(-1.23)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(5Z)-3-[(2,4-dichlorophenyl)methyl]-5-[[3-ethoxy-4-[(2-nitrophenyl)methoxy]phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)/C=C\3/C(=O)N(C(=O)S3)CC4=C(C=C(C=C4)Cl)Cl

DOS

IR

Vibrations