(1S,2S,5R,9S,12S)-13,13-Dimethyl-7-Oxatetracyclo[7.5.0.0~1,5~.0~2,12~]Tetradecane-4,8-Dione

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Formula C15H20O3
IUPAC Name (1s,2s,5r,9s,12s)-13,13-dimethyl-7-oxatetracyclo[7.5.0.0 1,5 .0 2,12 ]tetradecane-4,8-dione
Molecular Mass 248.317 g·mol−1
Heat of Formation -580.6 ± 16.7 kJ·mol−1
Dipole Moment 5.30 ± 1.08 D
Volume 294.34 Å 3
Surface Area 242.17 Å 2
HOMO Energy -10.22 ± 0.55 eV
LUMO Energy 0.66 ± eV
Point Group Symmetry C1
CAS Number(s)
  • 66550-08-1
InChIKey BBIDMUQZCCGABN-UXSWQMMLSA-N
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