Geometry & MOs

Info

ID:	70493
PubChem CID:	48413428
Reduced:	S2O3N4C16H22 (1)
Stoich.:	A2B3C4D16E22 (1)
Weight, g/mol:	407.052897
ΔH_f, kcal/mol:	-74.68
Dipole, Da:	4.05
IP(EA), eV:	-8.6(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1,3-benzothiazol-2-yl)piperidin-4-yl]-4-chlorobenzenesulfonamide

Drug info:

PubChemData

Smile

C1CN(CCC1NS(=O)(=O)N2CCOCC2)C3=NC4=CC=CC=C4S3

DOS

IR

Vibrations