Geometry & MOs

Info

ID:	86720
PubChem CID:	49888663
Reduced:	NS2O6H19C24 (1)
Stoich.:	AB2C6D19E24 (1)
Weight, g/mol:	522.101621
ΔH_f, kcal/mol:	-141.82
Dipole, Da:	5.25
IP(EA), eV:	-8.82(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(Z)-(3-benzyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-2-chloro-6-ethoxyphenoxy]-N-phenylacetamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=CC=CC=C3)OS(=O)(=O)C4=CC=CC=C4

DOS

IR

Vibrations