Geometry & MOs

Info

ID:	199239
PubChem CID:	79222289
Reduced:	SN2C17H26 (1)
Stoich.:	AB2C17D26 (1)
Weight, g/mol:	292.19732
ΔH_f, kcal/mol:	2.13
Dipole, Da:	3.09
IP(EA), eV:	-8.3(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-phenylsulfanylethyl)piperidin-3-yl]methyl]propan-1-amine

Drug info:

PubChemData

Smile

CCCNCC1CCCN1CC2CC3=CC=CC=C3S2

DOS

IR

Vibrations