Geometry & MOs

Info

ID:	87882
PubChem CID:	49898314
Reduced:	NSO4H21C24 (1)
Stoich.:	ABC4D21E24 (1)
Weight, g/mol:	391.087829
ΔH_f, kcal/mol:	-81.07
Dipole, Da:	2.93
IP(EA), eV:	-8.57(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(3-hydroxy-4-methoxyphenyl)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)OC

DOS

IR

Vibrations