Geometry & MOs

Info

ID:

87226

PubChem CID:

49893371

Reduced:

NSCl2O4H21C22 (1)

Stoich.:

ABC2D4E21F22 (1)

Weight, g/mol:

533.002212

ΔHf, kcal/mol:

-133.9

Dipole, Da:

6.82

IP(EA), eV:

-8.6(-1.14)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=C(C=C(C=C3)Cl)Cl)OC(C)C

DOS

IR

Vibrations