Geometry & MOs

Info

ID:

88048

PubChem CID:

49900181

Reduced:

NSCl4O4H13C24 (1)

Stoich.:

ABC4D4E13F24 (1)

Weight, g/mol:

568.96029

ΔHf, kcal/mol:

-98.13

Dipole, Da:

4.38

IP(EA), eV:

 -9.51(-1.4)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations