Geometry & MOs

Info

ID:	203524
PubChem CID:	79840699
Reduced:	ClON2C12H15 (1)
Stoich.:	ABC2D12E15 (1)
Weight, g/mol:	239.118925
ΔH_f, kcal/mol:	-23.05
Dipole, Da:	1.48
IP(EA), eV:	-8.96(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(3-chloropyridin-4-yl)-6-methylpiperidin-2-yl]methanamine

Drug info:

PubChemData

Smile

CC(=O)C1CCCCN1C2=C(C=NC=C2)Cl

DOS

IR

Vibrations