Geometry & MOs

Info

ID:	87280
PubChem CID:	49893656
Reduced:	BrNSO2H16C20 (1)
Stoich.:	ABCD2E16F20 (1)
Weight, g/mol:	450.97391
ΔH_f, kcal/mol:	-9.09
Dipole, Da:	2.73
IP(EA), eV:	-9.36(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN2C(=O)/C(=C/C(=C/C3=CC=CC=C3)/Br)/SC2=O

DOS

IR

Vibrations