Xorphanol

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Properties Simple | Detailed

Formula C23H31NO
IUPAC Name (1r,9r,10r,11s)-17-(cyclobutylmethyl)-11-methyl-13-methylene-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-ol
Molecular Mass 337.498 g·mol−1
Heat of Formation -112.7 ± 16.7 kJ·mol−1
Dipole Moment 0.84 ± 1.08 D
Volume 440.53 Å 3
Surface Area 351.79 Å 2
HOMO Energy -8.53 ± 0.55 eV
LUMO Energy 3.17 ± eV
Point Group Symmetry C1
InChIKey AZJPPZHRNFQRRE-HKDUHGGJSA-N
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