Geometry & MOs

Info

ID:	86985
PubChem CID:	49890353
Reduced:	NSBr2O4H7C11 (1)
Stoich.:	ABC2D4E7F11 (1)
Weight, g/mol:	268.991342
ΔH_f, kcal/mol:	-112.1
Dipole, Da:	4.52
IP(EA), eV:	-9.3(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=C(C(=C(C(=C1)/C=C\2/C(=O)NC(=O)S2)Br)Br)O

DOS

IR

Vibrations