Geometry & MOs

Info

ID:

86876

PubChem CID:

49889871

Reduced:

SN2Cl4O4H16C25 (1)

Stoich.:

AB2C4D4E16F25 (1)

Weight, g/mol:

684.90809

ΔHf, kcal/mol:

-108.09

Dipole, Da:

4.72

IP(EA), eV:

 -9.05(-1.78)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(5Z)-5-[[3,5-diiodo-4-[(3-methylphenyl)methoxy]phenyl]methylidene]-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC(=CC=C1NC(=O)COC2=C(C=C(C=C2)Cl)/C=C\3/C(=O)N(C(=O)S3)CC4=C(C=C(C=C4)Cl)Cl)Cl

DOS

IR

Vibrations