Geometry & MOs

Info

ID:	171217
PubChem CID:	75344514
Reduced:	SN2O5C24H24 (1)
Stoich.:	AB2C5D24E24 (1)
Weight, g/mol:	569.00052
ΔH_f, kcal/mol:	-138.87
Dipole, Da:	2.76
IP(EA), eV:	-9.02(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[[2,4-dioxo-3-(2-phenoxyethyl)-1,3-thiazolidin-5-ylidene]methyl]-2-ethoxy-6-iodophenoxy]acetic acid

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)CN2C(=O)C(=CC3=CC=C(C=C3)OCCOC4=CC=CC=C4)SC2=O

DOS

IR

Vibrations