Geometry & MOs

Info

ID:

174489

PubChem CID:

75772228

Reduced:

ON3C15H24 (1)

Stoich.:

AB3C15D24 (1)

Weight, g/mol:

261.184112

ΔHf, kcal/mol:

-11.93

Dipole, Da:

4.74

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.068314

Charge, e:

 0

Chem-info

IUPAC name:

N-[3-(2-pyridin-3-ylpiperidin-1-yl)propyl]acetamide

Drug info:

PubChemData

Smile

CC(=O)NCCC[NH+]1CCCCC1C2=CN=CC=C2

DOS

IR

Vibrations