Geometry & MOs

Info

ID:	275376
PubChem CID:	103815563
Reduced:	SN2O2C12H24 (1)
Stoich.:	AB2C2D12E24 (1)
Weight, g/mol:	276.187149
ΔH_f, kcal/mol:	-42.6
Dipole, Da:	4.17
IP(EA), eV:	-9.14(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-propylsulfonylethyl)piperidin-4-yl]methyl]ethanamine

Drug info:

PubChemData

Smile

CCCS(=O)(=O)CCN1CCC2CCC(C1)N2

DOS

IR

Vibrations