3-Oxo-1,3-Dihydro-2-Benzofuran-1-Yl (3α,16α)-Eburnamenine-14-Carboxylate

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Properties Simple | Detailed

Formula C28H26N2O4
IUPAC Name 3-oxo-1,3-dihydro-2-benzofuran-1-yl (3alpha,16alpha)-eburnamenine-14-carboxylate
Molecular Mass 454.517 g·mol−1
Heat of Formation 3885.4 ± 16.7 kJ·mol−1
Dipole Moment 9.96 ± 1.08 D
Volume 480.7 Å 3
Surface Area 367.76 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy -2.73 ± eV
Point Group Symmetry C1
InChIKey PEZLCFUBKMKIJA-RTVRTQBESA-N
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