Geometry & MOs

Info

ID:	87018
PubChem CID:	49890627
Reduced:	INS2O6H14C18 (1)
Stoich.:	ABC2D6E14F18 (1)
Weight, g/mol:	385.098394
ΔH_f, kcal/mol:	-158.72
Dipole, Da:	5.81
IP(EA), eV:	-8.14(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[3-ethoxy-4-(2-phenoxyethoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CCOC1=C(C(=CC(=C1)/C=C\2/C(=O)NC(=O)S2)I)OS(=O)(=O)C3=CC=CC=C3

DOS

IR

Vibrations