Geometry & MOs

Info

ID:	87019
PubChem CID:	49890638
Reduced:	NSO5H19C20 (1)
Stoich.:	ABC5D19E20 (1)
Weight, g/mol:	509.97464
ΔH_f, kcal/mol:	-135.95
Dipole, Da:	3.95
IP(EA), eV:	-8.8(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-2-iodo-6-methoxyphenoxy]-N-phenylacetamide

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)/C=C\2/C(=O)NC(=O)S2)OCCOC3=CC=CC=C3

DOS

IR

Vibrations