Geometry & MOs

Info

ID:	70215
PubChem CID:	47211719
Reduced:	ON5C14H23 (1)
Stoich.:	AB5C14D23 (1)
Weight, g/mol:	315.090518
ΔH_f, kcal/mol:	-10.03
Dipole, Da:	0.75
IP(EA), eV:	-8.66(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,6-dichloro-N-[2-(3-methylpiperidin-1-yl)ethyl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CN(CC(=O)NCCN1CCCCC1)C2=NC=CN=C2

DOS

IR

Vibrations