Geometry & MOs

Info

ID:	87027
PubChem CID:	49890752
Reduced:	SCl2N2O5H16C20 (1)
Stoich.:	AB2C2D5E16F20 (1)
Weight, g/mol:	406.119858
ΔH_f, kcal/mol:	-145.39
Dipole, Da:	3.48
IP(EA), eV:	-9.08(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(4-ethoxy-3-methoxyphenyl)methylidene]-3-(2-morpholin-4-yl-2-oxoethyl)-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1COCCN1C(=O)CN2C(=O)/C(=C/C3=CC=C(O3)C4=C(C=C(C=C4)Cl)Cl)/SC2=O

DOS

IR

Vibrations