Geometry & MOs

Info

ID:	440159
PubChem CID:	135230068
Reduced:	ON3C23H39 (1)
Stoich.:	AB3C23D39 (1)
Weight, g/mol:	357.314398
ΔH_f, kcal/mol:	-66.46
Dipole, Da:	3.63
IP(EA), eV:	-8.43(2.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[1-[(1-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2-azabicyclo[2.1.1]hexan-2-yl]methyl]-2-azabicyclo[3.2.2]nonane

Drug info:

PubChemData

Smile

CC12CC(C(N1)CC34CCCN(C3)C(CC4)CC56CCN(CC5)CC6)OC2

DOS

IR

Vibrations