(5α,6α)-6-Hydroxy-17-Methyl-7,8-Didehydro-4,5-Epoxymorphinan-3-Yl Propionate

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Formula C20H23NO4
IUPAC Name [(3s,4r,4ar,7r,7ar,12bs)-7-hydroxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1h-4,12-methanobenzofuro[3,2-e]isoquinoline-9-yl] propanoate
Molecular Mass 341.401 g·mol−1
Heat of Formation -526.3 ± 16.7 kJ·mol−1
Dipole Moment 2.52 ± 1.08 D
Volume 398.7 Å 3
Surface Area 332.16 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy 3.13 ± eV
Point Group Symmetry C1
InChIKey LSYABJYKSBROSB-WUJZHNIKSA-N
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