Methyl 16,17-Didehydroyohimban-16-Carboxylate

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Formula C21H24N2O2
IUPAC Name methyl (1s,13r,15r,20s)-1,3,11,12,14,15,16,17,20,21-decahydroyohimban-19-carboxylate
Molecular Mass 336.427 g·mol−1
Heat of Formation -139.8 ± 16.7 kJ·mol−1
Dipole Moment 2.60 ± 1.08 D
Volume 408.92 Å 3
Surface Area 352.22 Å 2
HOMO Energy -8.16 ± 0.55 eV
LUMO Energy 0.12 ± eV
Point Group Symmetry C1
InChIKey DFDNBRUSLQYVNA-IXDGSTSKSA-N
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