(1Ar,4E,7As,10As,10Br)-1A,5-Dimethyl-8-Methylene-2,3,6,7,7A,8,10A,10B-Octahydrooxireno[9,10]Cyclodeca[1,2-B]Furan-9(1Ah)-One

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Formula C15H20O3
IUPAC Name (1ar,4e,7as,10as,10br)-1a,5-dimethyl-8-methylene-2,3,6,7,7a,8,10a,10b-octahydrooxireno[9,10]cyclodeca[1,2-b]furan-9(1ah)-one
Molecular Mass 248.317 g·mol−1
Heat of Formation -368.2 ± 16.7 kJ·mol−1
Dipole Moment 7.22 ± 1.08 D
Volume 313.75 Å 3
Surface Area 260.32 Å 2
HOMO Energy -9.72 ± 0.55 eV
LUMO Energy -0.25 ± eV
Point Group Symmetry C1
Synonyms
  • bcbcmap01_000041
  • bpbio1_000659
  • parthenolide, <i>tanacetum parthenium
InChIKey KTEXNACQROZXEV-PVLRGYAZSA-N
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