Geometry & MOs

Info

ID:

88239

PubChem CID:

49902507

Reduced:

NSO3Cl5H14C24 (1)

Stoich.:

ABC3D5E14F24 (1)

Weight, g/mol:

668.88732

ΔHf, kcal/mol:

-67.31

Dipole, Da:

1.84

IP(EA), eV:

 -9.52(-1.43)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(5Z)-3-[(4-bromophenyl)methyl]-5-[[4-[(2-chlorophenyl)methoxy]-3-iodo-5-methoxyphenyl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Cl)CN2C(=O)/C(=C/C3=CC(=C(C(=C3)Cl)OCC4=CC(=C(C=C4)Cl)Cl)Cl)/SC2=O

DOS

IR

Vibrations