Geometry & MOs

Info

ID:	137782
PubChem CID:	52261088
Reduced:	ON2C19H22 (1)
Stoich.:	AB2C19D22 (1)
Weight, g/mol:	353.11028
ΔH_f, kcal/mol:	-12.41
Dipole, Da:	3.75
IP(EA), eV:	-8.49(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[3-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCCC(=O)NC1=CC=CC=C1CN2CCC3=CC=CC=C32

DOS

IR

Vibrations