Geometry & MOs

Info

ID:	240894
PubChem CID:	93618074
Reduced:	NOC7H13 (2)
Stoich.:	ABC7D13 (2)
Weight, g/mol:	261.184112
ΔH_f, kcal/mol:	-116.38
Dipole, Da:	3.47
IP(EA), eV:	-8.65(1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]ethyl]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

C[C@H]1C[C@@H](CN(C1)CCNC(=O)[C@@H]2CCCO2)C

DOS

IR

Vibrations