5,11,16-Trioxo-3,8-Didehydrosenecionan-12-Yl Acetate

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Properties Simple | Detailed

Formula C20H23NO7
IUPAC Name (7beta)-5,11,16-trioxo-3,8-didehydrosenecionan-12-yl acetate
Molecular Mass 389.399 g·mol−1
Heat of Formation -1143.8 ± 16.7 kJ·mol−1
Dipole Moment 4.23 ± 1.08 D
Volume 446.68 Å 3
Surface Area 359.51 Å 2
HOMO Energy -9.45 ± 0.55 eV
LUMO Energy 2.48 ± eV
Point Group Symmetry C1
Synonyms
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InChIKey NTGIQQBAUYBEBF-KYRPGFEVSA-N
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