Geometry & MOs

Info

ID:	249318
PubChem CID:	103088579
Reduced:	SN3C14H25 (1)
Stoich.:	AB3C14D25 (1)
Weight, g/mol:	306.21297
ΔH_f, kcal/mol:	14.85
Dipole, Da:	3.51
IP(EA), eV:	-8.58(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-benzylpiperidin-1-yl)-5-methylsulfanylpentan-1-amine

Drug info:

PubChemData

Smile

CN(CCC1=CC=CC=N1)C(CCCSC)CN

DOS

IR

Vibrations