Geometry & MOs

Info

ID:	249437
PubChem CID:	103089417
Reduced:	NOSC10H23 (1)
Stoich.:	ABCD10E23 (1)
Weight, g/mol:	230.18167
ΔH_f, kcal/mol:	-84.56
Dipole, Da:	1.89
IP(EA), eV:	-8.56(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-[1-(4-methylsulfanylbutyl)piperidin-3-yl]methanamine

Drug info:

PubChemData

Smile

CC(C)CC(C(CCCSC)O)N

DOS

IR

Vibrations