(5α,6Beta)-17-Methyl-4,5-Epoxymorphinan-3,6-Diol

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Formula C17H21NO3
IUPAC Name (4r,4ar,7r,7ar,12bs)-3-methyl-2,4,4a,5,6,7,7a,13-octahydro-1h-4,12-methanobenzofuro[3,2-e]isoquinoline-7,9-diol
Molecular Mass 287.354 g·mol−1
Heat of Formation -426.0 ± 16.7 kJ·mol−1
Dipole Moment 3.99 ± 1.08 D
Volume 335.53 Å 3
Surface Area 277.37 Å 2
HOMO Energy -8.54 ± 0.55 eV
LUMO Energy 0.07 ± eV
Point Group Symmetry C1
InChIKey IJVCSMSMFSCRME-NOSXKOESSA-N
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