Geometry & MOs

Info

ID:

86677

PubChem CID:

49888451

Reduced:

ClNS2O6H20C25 (1)

Stoich.:

ABC2D6E20F25 (1)

Weight, g/mol:

672.91451

ΔHf, kcal/mol:

-157.72

Dipole, Da:

5.97

IP(EA), eV:

 -8.9(-1.29)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=CC=CC=C3)OS(=O)(=O)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations