Geometry & MOs

Info

ID:	171259
PubChem CID:	75350751
Reduced:	BrClNSO6H15C20 (1)
Stoich.:	ABCDE6F15G20 (1)
Weight, g/mol:	373.053942
ΔH_f, kcal/mol:	-178.7
Dipole, Da:	1.24
IP(EA), eV:	-9.03(-1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-chlorophenyl)methylidene]-3-[2-(4-methylphenoxy)ethyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC(=CC=C1OCCN2C(=O)C(=CC3=CC(=C(C=C3)OCC(=O)O)Br)SC2=O)Cl

DOS

IR

Vibrations