Geometry & MOs

Info

ID:

87845

PubChem CID:

49897894

Reduced:

ClNSO4H18C28 (1)

Stoich.:

ABCD4E18F28 (1)

Weight, g/mol:

590.96735

ΔHf, kcal/mol:

-57.22

Dipole, Da:

5.55

IP(EA), eV:

 -8.81(-1.26)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(5Z)-5-[[3-bromo-5-methoxy-4-[(2-methylphenyl)methoxy]phenyl]methylidene]-3-[(3,4-dichlorophenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC=C2CN3C(=O)/C(=C/C4=CC(=CC=C4)OC(=O)C5=CC=CC=C5Cl)/SC3=O

DOS

IR

Vibrations