Geometry & MOs

Info

ID:	362492
PubChem CID:	127308031
Reduced:	ClNO3C17H24 (1)
Stoich.:	ABC3D17E24 (1)
Weight, g/mol:	282.194343
ΔH_f, kcal/mol:	-40.44
Dipole, Da:	2.37
IP(EA), eV:	-8.9(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-N-(oxolan-2-ylmethyl)propanamide

Drug info:

PubChemData

Smile

C1CC2CC(CC1N2CC(COCC3=CC=CC=C3Cl)O)O

DOS

IR

Vibrations