Geometry & MOs

Info

ID:	344976
PubChem CID:	127268736
Reduced:	NSO3C12H23 (1)
Stoich.:	ABC3D12E23 (1)
Weight, g/mol:	378.1647
ΔH_f, kcal/mol:	-161.73
Dipole, Da:	3.39
IP(EA), eV:	-9.87(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(2,5-dimethylpyrrolidin-1-yl)piperidin-1-yl]sulfonylthiane 1,1-dioxide

Drug info:

PubChemData

Smile

CC1(CCCCC1)NS(=O)(=O)CC2CCCO2

DOS

IR

Vibrations