Geometry & MOs

Info

ID:	209687
PubChem CID:	80703792
Reduced:	ClSN2O2H9C10 (1)
Stoich.:	ABC2D2E9F10 (1)
Weight, g/mol:	320.041998
ΔH_f, kcal/mol:	-7.07
Dipole, Da:	4.92
IP(EA), eV:	-10.23(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-3-(3-methylbutylsulfamoyl)benzenecarbothioamide

Drug info:

PubChemData

Smile

C=CCNS(=O)(=O)C1=C(C=CC(=C1)C#N)Cl

DOS

IR

Vibrations