Geometry & MOs

Info

ID:	147849
PubChem CID:	53787507
Reduced:	Cl2N3O3H29C35 (1)
Stoich.:	A2B3C3D29E35 (1)
Weight, g/mol:	173.014664
ΔH_f, kcal/mol:	-2.32
Dipole, Da:	7.06
IP(EA), eV:	-9.09(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(ethoxymethylidene)-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CNC(=O)C1=CC=C(C=C1)C=CC2=CC(=CC=C2)C(=O)N(C)C3=C(C(=C(C=C3)Cl)COCC4=CC=CC5=C4N=CC=C5)Cl

DOS

IR

Vibrations