(12S,15R)-15-Hydroxy-11,16-Dioxo-15,20-Dihydrosenecionan-12-Yl Acetate

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Properties Simple | Detailed

Formula C20H29NO7
IUPAC Name (12s,15r)-15-hydroxy-11,16-dioxo-15,20-dihydrosenecionan-12-yl acetate
Molecular Mass 395.447 g·mol−1
Heat of Formation -1288.8 ± 16.7 kJ·mol−1
Dipole Moment 2.48 ± 1.08 D
Volume 468.93 Å 3
Surface Area 351.6 Å 2
HOMO Energy -8.90 ± 0.55 eV
LUMO Energy 0.59 ± eV
Point Group Symmetry C1
CAS Number(s)
  • 30000-36-3
InChIKey IYLGZMTXKJYONK-ACLXAEORSA-N
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