Geometry & MOs

Info

ID:	171170
PubChem CID:	75338661
Reduced:	NSCl2O5H15C16 (1)
Stoich.:	ABC2D5E15F16 (1)
Weight, g/mol:	562.04093
ΔH_f, kcal/mol:	-192.43
Dipole, Da:	1.51
IP(EA), eV:	-9.31(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[5-[[4-(2-anilino-2-oxoethoxy)-3-bromo-5-ethoxyphenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetate

Drug info:

PubChemData

Smile

CC(C)OC(=O)CN1C(=O)C(=CC2=CC(=C(C(=C2)Cl)OC)Cl)SC1=O

DOS

IR

Vibrations