Geometry & MOs

Info

ID:

86620

PubChem CID:

49887678

Reduced:

BrNSCl2O4H14C24 (1)

Stoich.:

ABCD2E4F14G24 (1)

Weight, g/mol:

553.088135

ΔHf, kcal/mol:

-81.26

Dipole, Da:

1.1

IP(EA), eV:

 -9.73(-1.44)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(5Z)-5-[[4-[(4-chlorophenyl)methoxy]-3-ethoxy-5-prop-2-enylphenyl]methylidene]-3-[(2-chlorophenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations