3-[(1S,5R,9R)-2,9-Dimethyl-2-Azabicyclo[3.3.1]Non-5-Yl]Phenol

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Properties Simple | Detailed

Formula C16H23NO
IUPAC Name 3-[(1r,5s,9s)-2,9-dimethyl-2-azabicyclo[3.3.1]nonan-5-yl]phenol
Molecular Mass 245.360 g·mol−1
Heat of Formation -161.3 ± 16.7 kJ·mol−1
Dipole Moment 2.82 ± 1.08 D
Volume 316.66 Å 3
Surface Area 267.91 Å 2
HOMO Energy -8.53 ± 0.55 eV
LUMO Energy 0.21 ± eV
Point Group Symmetry C1
InChIKey JBSRPCWYMOJXAM-WQVCFCJDSA-N
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