Geometry & MOs

Info

ID:	304201
PubChem CID:	124498630
Reduced:	ClN2O2C18H19 (1)
Stoich.:	AB2C2D18E19 (1)
Weight, g/mol:	224.108026
ΔH_f, kcal/mol:	-50.83
Dipole, Da:	6.58
IP(EA), eV:	-9.62(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-2-methyl-3-[(2R)-1-methylpiperidin-2-yl]pyridine

Drug info:

PubChemData

Smile

CC1=CC(=NC=C1[C@@H]2CCCN2C(=O)OCC3=CC=CC=C3)Cl

DOS

IR

Vibrations