1-(4-Fluorophenyl)-4-(1,4,5,6-Tetrahydro-8-Hydroxy-6,11-Dimethyl-2,6-Methano-3-Benzazocin-3(2H)-Yl)-1-Butanone

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Properties Simple | Detailed

Formula C24H28FNO2
IUPAC Name 1-(4-fluorophenyl)-4-[(1r,9r,13r)-4-hydroxy-1,13-dimethyl-10-azatricyclo[7.3.1.0 2,7 ]trideca-2,4,6-trien-10-yl]-1-butanone
Molecular Mass 381.483 g·mol−1
Heat of Formation -444.0 ± 16.7 kJ·mol−1
Dipole Moment 3.22 ± 1.08 D
Volume 470.97 Å 3
Surface Area 396.45 Å 2
HOMO Energy -8.61 ± 0.55 eV
LUMO Energy -0.72 ± eV
Point Group Symmetry C1
InChIKey SMDNOEGDKSJRPV-LZGLPUDESA-N
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Elements H C N O F