4-Amino-5-Chloro-N-[(3-Exo)-9-(4-Fluorobenzyl)-9-Azabicyclo[3.3.1]Non-3-Yl]-2-Methoxybenzamide

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Properties Simple | Detailed

Formula C23H27ClFN3O2
IUPAC Name 4-amino-5-chloro-n-[(1s,5r)-9-[(4-fluorophenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl]-2-methoxy-benzamide
Molecular Mass 431.931 g·mol−1
Heat of Formation -443.8 ± 16.7 kJ·mol−1
Dipole Moment 7.00 ± 1.08 D
Volume 501.22 Å 3
Surface Area 424.66 Å 2
HOMO Energy -8.80 ± 0.55 eV
LUMO Energy -0.30 ± eV
Point Group Symmetry C1
InChIKey PSOJUYFGYMSZHW-NNZMDNLPSA-N
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Elements C F H Cl O N