Geometry & MOs

Info

ID:	86758
PubChem CID:	49888926
Reduced:	N2S2O7H22C26 (1)
Stoich.:	A2B2C7D22E26 (1)
Weight, g/mol:	325.077265
ΔH_f, kcal/mol:	-196.02
Dipole, Da:	6.17
IP(EA), eV:	-8.92(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC=C2OC)/C=C\3/C(=O)N(C(=O)S3)CC4=CC=CC=C4

DOS

IR

Vibrations