Geometry & MOs

Info

ID:	87904
PubChem CID:	49898516
Reduced:	ClNSO4H22C25 (1)
Stoich.:	ABCD4E22F25 (1)
Weight, g/mol:	389.108565
ΔH_f, kcal/mol:	-98.83
Dipole, Da:	4.36
IP(EA), eV:	-8.7(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=C(C(=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=CC4=CC=CC=C4C=C3)Cl)OCC

DOS

IR

Vibrations