Geometry & MOs

Info

ID:	284637
PubChem CID:	104056419
Reduced:	ClSO2N3C14H20 (1)
Stoich.:	ABC2D3E14F20 (1)
Weight, g/mol:	320.041998
ΔH_f, kcal/mol:	-37.77
Dipole, Da:	5.49
IP(EA), eV:	-8.88(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-4-(pentan-2-ylsulfamoyl)benzenecarbothioamide

Drug info:

PubChemData

Smile

CC(C)(CNS(=O)(=O)C1=C(C=C(C=C1)C#N)Cl)CN(C)C

DOS

IR

Vibrations