(3S)-1-Azabicyclo[2.2.2]Oct-3-Yl (1S)-1-Phenyl-3,4-Dihydro-2(1H)-Isoquinolinecarboxylate

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Properties Simple | Detailed

Formula C23H26N2O2
IUPAC Name [(3s)-quinuclidin-3-yl] (1s)-1-phenyl-3,4-dihydro-1h-isoquinoline-2-carboxylate
Molecular Mass 362.465 g·mol−1
Heat of Formation -176.4 ± 16.7 kJ·mol−1
Dipole Moment 3.44 ± 1.08 D
Volume 443.9 Å 3
Surface Area 363.65 Å 2
HOMO Energy -8.95 ± 0.55 eV
LUMO Energy 3.04 ± eV
Point Group Symmetry C1
InChIKey FBOUYBDGKBSUES-YADHBBJMSA-N
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