Geometry & MOs

Info

ID:	87951
PubChem CID:	49898914
Reduced:	ClNS2O6H20C28 (1)
Stoich.:	ABC2D6E20F28 (1)
Weight, g/mol:	359.098
ΔH_f, kcal/mol:	-134.43
Dipole, Da:	3.93
IP(EA), eV:	-8.84(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(4-methylphenyl)methylidene]-3-(naphthalen-2-ylmethyl)-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=CC=CC4=CC=CC=C43)OS(=O)(=O)C5=CC=C(C=C5)Cl

DOS

IR

Vibrations