Geometry & MOs

Info

ID:	198053
PubChem CID:	79038577
Reduced:	ClN3C14H22 (1)
Stoich.:	AB3C14D22 (1)
Weight, g/mol:	252.102941
ΔH_f, kcal/mol:	11.9
Dipole, Da:	4.78
IP(EA), eV:	-8.4(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[(6-chloropyridin-2-yl)methyl]-8-azabicyclo[3.2.1]octan-3-ol

Drug info:

PubChemData

Smile

CN1CCC(CC1)CN(C)CC2=NC(=CC=C2)Cl

DOS

IR

Vibrations