Geometry & MOs

Info

ID:	86987
PubChem CID:	49890367
Reduced:	SN3O7H21C23 (1)
Stoich.:	AB3C7D21E23 (1)
Weight, g/mol:	299.061614
ΔH_f, kcal/mol:	-143.57
Dipole, Da:	7.92
IP(EA), eV:	-9.66(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(2-ethoxynaphthalen-1-yl)methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1COCCN1C(=O)CN2C(=O)/C(=C/C3=C(C(=CC(=C3)CC4=CC=CC=C4)[N+](=O)[O-])O)/SC2=O

DOS

IR

Vibrations