Geometry & MOs

Info

ID:	344926
PubChem CID:	127268686
Reduced:	ClNS2O4C15H20 (1)
Stoich.:	ABC2D4E15F20 (1)
Weight, g/mol:	393.058376
ΔH_f, kcal/mol:	-162.99
Dipole, Da:	8.67
IP(EA), eV:	-9.77(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(3-chloropyridin-2-yl)piperazin-1-yl]sulfonylthiane 1,1-dioxide

Drug info:

PubChemData

Smile

C1CC(N(C1)S(=O)(=O)C2CCS(=O)(=O)CC2)C3=CC=CC=C3Cl

DOS

IR

Vibrations