Geometry & MOs

Info

ID:	282777
PubChem CID:	103938675
Reduced:	N2O2C17H22 (1)
Stoich.:	A2B2C17D22 (1)
Weight, g/mol:	248.188863
ΔH_f, kcal/mol:	-44.47
Dipole, Da:	5.49
IP(EA), eV:	-8.77(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[5-(2,3-dimethylpiperidin-1-yl)pyridin-2-yl]propan-1-ol

Drug info:

PubChemData

Smile

CC[C@H](C1=NC=C(C=C1)N(CCO)CC2=CC=CC=C2)O

DOS

IR

Vibrations