Geometry & MOs

Info

ID:	207025
PubChem CID:	80335267
Reduced:	ON3C16H27 (1)
Stoich.:	AB3C16D27 (1)
Weight, g/mol:	249.184112
ΔH_f, kcal/mol:	-37.84
Dipole, Da:	4.61
IP(EA), eV:	-8.41(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[2-(4-ethoxypiperidin-1-yl)pyridin-4-yl]ethanamine

Drug info:

PubChemData

Smile

CC(C1=CC(=NC=C1)N(CCO)C2CCCCC2)NC

DOS

IR

Vibrations