1-Azabicyclo[2.2.2]Oct-2-Yl(3,4-Dihydro-2(1H)-Isoquinolinyl)Methanone

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Formula C17H22N2O
IUPAC Name 3,4-dihydro-1h-isoquinolin-2-yl-[(2s)-quinuclidin-2-yl]methanone
Molecular Mass 270.369 g·mol−1
Heat of Formation -106.7 ± 16.7 kJ·mol−1
Dipole Moment 2.33 ± 1.08 D
Volume 340.64 Å 3
Surface Area 275.53 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy 3.32 ± eV
Point Group Symmetry C1
InChIKey RKDZZPJYJNXRON-INIZCTEOSA-N
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