Geometry & MOs

Info

ID:

86895

PubChem CID:

49889930

Reduced:

FNSO3H22C25 (1)

Stoich.:

ABCD3E22F25 (1)

Weight, g/mol:

676.88944

ΔHf, kcal/mol:

-103.78

Dipole, Da:

3.31

IP(EA), eV:

 -8.9(-1.15)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(5Z)-5-[[4-[(2-chloro-6-fluorophenyl)methoxy]-3-iodo-5-methoxyphenyl]methylidene]-3-[(2,4-dichlorophenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CCCCOC1=C(C2=CC=CC=C2C=C1)/C=C\3/C(=O)N(C(=O)S3)CC4=CC=C(C=C4)F

DOS

IR

Vibrations