Geometry & MOs

Info

ID:

86888

PubChem CID:

49889896

Reduced:

FSN2O6H15C24 (1)

Stoich.:

ABC2D6E15F24 (1)

Weight, g/mol:

483.070735

ΔHf, kcal/mol:

-116.99

Dipole, Da:

6.54

IP(EA), eV:

 -9.73(-1.89)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)OC(=O)C2=CC(=CC=C2)[N+](=O)[O-])/C=C\3/C(=O)N(C(=O)S3)CC4=CC=C(C=C4)F

DOS

IR

Vibrations