Geometry & MOs

Info

ID:	171043
PubChem CID:	75317191
Reduced:	FNSBr2O3H10C17 (1)
Stoich.:	ABCD2E3F10G17 (1)
Weight, g/mol:	317.018036
ΔH_f, kcal/mol:	-88.3
Dipole, Da:	3.0
IP(EA), eV:	-9.56(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)COC2=C(C=C(C=C2Br)C=C3C(=O)NC(=O)S3)Br)F

DOS

IR

Vibrations