Methyl (3α,5α,12Beta,20R)-6,7-Didehydro-2,20-Cycloaspidospermidine-3-Carboxylate

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Properties Simple | Detailed

Formula C21H24N2O2
IUPAC Name methyl (3alpha,5alpha,12beta,20r)-6,7-didehydro-2,20-cycloaspidospermidine-3-carboxylate
Molecular Mass 336.427 g·mol−1
Heat of Formation -77.6 ± 16.7 kJ·mol−1
Dipole Moment 2.71 ± 1.08 D
Volume 398.8 Å 3
Surface Area 316.78 Å 2
HOMO Energy -8.29 ± 0.55 eV
LUMO Energy 0.33 ± eV
Point Group Symmetry C1
Synonyms
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InChIKey JSLDLCGKZDUQSH-SBDPWIONSA-N
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