Geometry & MOs

Info

ID:	177193
PubChem CID:	76145333
Reduced:	N3O3C19H19 (1)
Stoich.:	A3B3C19D19 (1)
Weight, g/mol:	247.133907
ΔH_f, kcal/mol:	-38.05
Dipole, Da:	2.23
IP(EA), eV:	-9.23(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(oxan-4-yloxy)-8-azabicyclo[3.2.1]octane;hydrochloride

Drug info:

PubChemData

Smile

CC(C)OC1=C(C=CC=N1)CNC(=O)C2=NC=C(O2)C3=CC=CC=C3

DOS

IR

Vibrations