Geometry & MOs

Info

ID:	189702
PubChem CID:	77892000
Reduced:	NOC21H33 (1)
Stoich.:	ABC21D33 (1)
Weight, g/mol:	332.209993
ΔH_f, kcal/mol:	-62.24
Dipole, Da:	1.08
IP(EA), eV:	-8.52(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-(6-ethylpyridin-2-yl)oxy-8-azabicyclo[3.2.1]octane-8-carboxylate

Drug info:

PubChemData

Smile

CCCC1CCC(CC1)C2CCCN2C(CO)C3=CC=CC=C3

DOS

IR

Vibrations