Geometry & MOs

Info

ID:	339066
PubChem CID:	127260077
Reduced:	S2O3H12C13 (1)
Stoich.:	A2B3C12D13 (1)
Weight, g/mol:	340.94057
ΔH_f, kcal/mol:	-77.83
Dipole, Da:	4.81
IP(EA), eV:	-8.83(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chloro-1,3-benzothiazol-2-yl)oxy-oxo-phenyl-sulfanylidene-lambda6-sulfane

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)O)OS(=O)(=S)C2=CC=CC=C2

DOS

IR

Vibrations