Geometry & MOs

Info

ID:	235386
PubChem CID:	92310319
Reduced:	N2S2O3H14C20 (1)
Stoich.:	A2B2C3D14E20 (1)
Weight, g/mol:	288.945655
ΔH_f, kcal/mol:	-5.99
Dipole, Da:	4.85
IP(EA), eV:	-8.69(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(5-chlorothiophen-2-yl)methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

CCN1C(=O)/C(=C/C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O)/C(=S)S1

DOS

IR

Vibrations