Geometry & MOs

Info

ID:	86984
PubChem CID:	49890351
Reduced:	SCl2N2O5H14C16 (1)
Stoich.:	AB2C2D5E14F16 (1)
Weight, g/mol:	408.8442
ΔH_f, kcal/mol:	-177.9
Dipole, Da:	2.47
IP(EA), eV:	-9.43(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(2,3-dibromo-4-hydroxy-5-methoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1COCCN1C(=O)CN2C(=O)/C(=C/C3=CC(=C(C(=C3)Cl)O)Cl)/SC2=O

DOS

IR

Vibrations