Geometry & MOs

Info

ID:	282785
PubChem CID:	103938795
Reduced:	ON2C14H22 (1)
Stoich.:	AB2C14D22 (1)
Weight, g/mol:	248.188863
ΔH_f, kcal/mol:	-16.36
Dipole, Da:	1.75
IP(EA), eV:	-8.24(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC[C@@H](C1=NC=C(C=C1)N(C)CC2CC2C)O

DOS

IR

Vibrations