4-Hydroxy-3,7-Dimethoxy-7,8-Didehydromorphinan-6-One

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Formula C18H21NO4
IUPAC Name (1s,9r,10r)-3-hydroxy-4,12-dimethoxy-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5,11-tetraen-13-one
Molecular Mass 315.364 g·mol−1
Heat of Formation -497.8 ± 16.7 kJ·mol−1
Dipole Moment 3.63 ± 1.08 D
Volume 372.26 Å 3
Surface Area 299.51 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy 0.05 ± eV
Point Group Symmetry C1
InChIKey BJJRDCBDIOEIKD-IUUKEHGRSA-N
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