Geometry & MOs

Info

ID:

86782

PubChem CID:

49889307

Reduced:

FSN2O5H25C28 (1)

Stoich.:

ABC2D5E25F28 (1)

Weight, g/mol:

642.92841

ΔHf, kcal/mol:

-169.69

Dipole, Da:

6.47

IP(EA), eV:

 -8.83(-1.43)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)NC(=O)COC2=C(C=C(C=C2)/C=C\3/C(=O)N(C(=O)S3)CC4=CC=C(C=C4)F)OC)C

DOS

IR

Vibrations