Geometry & MOs

Info

ID:	284642
PubChem CID:	104057017
Reduced:	ClN2O2S2C12H17 (1)
Stoich.:	AB2C2D2E12F17 (1)
Weight, g/mol:	338.016177
ΔH_f, kcal/mol:	-69.25
Dipole, Da:	1.33
IP(EA), eV:	-8.98(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[bis(2-hydroxyethyl)sulfamoyl]-3-chlorobenzenecarbothioamide

Drug info:

PubChemData

Smile

CC(C)(C)CNS(=O)(=O)C1=CC(=C(C=C1)C(=S)N)Cl

DOS

IR

Vibrations