Geometry & MOs

Info

ID:	281965
PubChem CID:	103914609
Reduced:	SN2O2C12H18 (1)
Stoich.:	AB2C2D12E18 (1)
Weight, g/mol:	247.204848
ΔH_f, kcal/mol:	-70.45
Dipole, Da:	6.11
IP(EA), eV:	-9.68(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-methylpyridin-3-yl)methyl]-1-propylpiperidin-4-amine

Drug info:

PubChemData

Smile

CC1=CC(=CN=C1)CNC2CCCS(=O)(=O)C2

DOS

IR

Vibrations