3-[9-Methoxy-3-(2-Phenylethyl)-3-Azabicyclo[3.3.1]Non-9-Yl]Phenyl Propionate

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Formula C26H33NO3
IUPAC Name [3-[(1r,5s)-9-methoxy-3-(2-phenylethyl)-3-azabicyclo[3.3.1]nonan-9-yl]phenyl] propanoate
Molecular Mass 407.545 g·mol−1
Heat of Formation -408.9 ± 16.7 kJ·mol−1
Dipole Moment 2.77 ± 1.08 D
Volume 513.97 Å 3
Surface Area 430.76 Å 2
HOMO Energy -8.39 ± 0.55 eV
LUMO Energy 0.07 ± eV
Point Group Symmetry C1
InChIKey QAFCCMUYUJLRJL-QXSURTEESA-N
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