Geometry & MOs

Info

ID:	87455
PubChem CID:	49894734
Reduced:	SN2O4H22C26 (1)
Stoich.:	AB2C4D22E26 (1)
Weight, g/mol:	523.03143
ΔH_f, kcal/mol:	-78.8
Dipole, Da:	3.58
IP(EA), eV:	-8.97(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(3-iodo-5-methoxy-4-propoxyphenyl)methylidene]-3-[(2-methylphenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CN2C(=O)/C(=C/C3=CC=CC=C3OCC(=O)NC4=CC=CC=C4)/SC2=O

DOS

IR

Vibrations