Geometry & MOs

Info

ID:	362650
PubChem CID:	127308928
Reduced:	FN3O3C18H24 (1)
Stoich.:	AB3C3D18E24 (1)
Weight, g/mol:	350.164185
ΔH_f, kcal/mol:	-152.34
Dipole, Da:	2.05
IP(EA), eV:	-8.68(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethyl]-3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxamide

Drug info:

PubChemData

Smile

C1CC2CN(CCN2C1)C(=O)NCCC3=CC(=CC4=C3OCOC4)F

DOS

IR

Vibrations