Geometry & MOs

Info

ID:	392928
PubChem CID:	135018557
Reduced:	O7C14H20 (1)
Stoich.:	A7B14C20 (1)
Weight, g/mol:	324.220164
ΔH_f, kcal/mol:	-298.66
Dipole, Da:	2.24
IP(EA), eV:	-10.59(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1S)-1-(5-ethyl-1-azabicyclo[2.2.2]octan-2-yl)ethyl]-6-methoxyquinoline

Drug info:

PubChemData

Smile

COC(=O)C(=C)[C@H]1CCC(C[C@H]1O)(C(=O)OC)C(=O)OC

DOS

IR

Vibrations