2-(1-Azabicyclo[2.2.2]Oct-2-Ylmethyl)-1,2,3,4-Tetrahydroisoquinoline

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Properties Simple | Detailed

Formula C17H24N2
IUPAC Name (2s)-2-[[(2s)-quinuclidin-2-yl]methyl]-3,4-dihydro-1h-isoquinoline
Molecular Mass 256.386 g·mol−1
Heat of Formation 88.7 ± 16.7 kJ·mol−1
Dipole Moment 1.29 ± 1.08 D
Volume 336.0 Å 3
Surface Area 293.84 Å 2
HOMO Energy -8.73 ± 0.55 eV
LUMO Energy 3.36 ± eV
Point Group Symmetry C1
InChIKey UDQPNLNGJOGMLY-KRWDZBQOSA-N
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Elements H C N