Geometry & MOs

Info

ID:	284648
PubChem CID:	104057039
Reduced:	ClN2O2S2C13H19 (1)
Stoich.:	AB2C2D2E13F19 (1)
Weight, g/mol:	334.057648
ΔH_f, kcal/mol:	-67.7
Dipole, Da:	1.06
IP(EA), eV:	-8.98(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-4-[methyl(3-methylbutyl)sulfamoyl]benzenecarbothioamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations