Geometry & MOs

Info

ID:	88012
PubChem CID:	49899744
Reduced:	FNSCl2O3H12C21 (1)
Stoich.:	ABCD2E3F12G21 (1)
Weight, g/mol:	554.89597
ΔH_f, kcal/mol:	-90.66
Dipole, Da:	3.16
IP(EA), eV:	-8.96(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-3-[(2,6-dichlorophenyl)methyl]-5-[[5-(4-iodophenyl)furan-2-yl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Cl)CN2C(=O)/C(=C/C3=CC=C(O3)C4=CC=C(C=C4)F)/SC2=O)Cl

DOS

IR

Vibrations