Geometry & MOs

Info

ID:	87416
PubChem CID:	49894524
Reduced:	NSO2H19C26 (1)
Stoich.:	ABC2D19E26 (1)
Weight, g/mol:	355.087829
ΔH_f, kcal/mol:	11.62
Dipole, Da:	2.59
IP(EA), eV:	-8.62(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(2-hydroxy-3-methoxyphenyl)methylidene]-3-[(4-methylphenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN2C(=O)/C(=C/C3=C4C=CC=CC4=CC5=CC=CC=C53)/SC2=O

DOS

IR

Vibrations