(1S,6R)-3,7,7-Trimethylbicyclo[4.1.0]Hept-3-Ene-2,5-Dione

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Properties Simple | Detailed

Formula C10H12O2
IUPAC Name (1r,6s)-4,7,7-trimethylbicyclo[4.1.0]hept-3-ene-2,5-dione
Molecular Mass 164.201 g·mol−1
Heat of Formation -223.7 ± 16.7 kJ·mol−1
Dipole Moment 1.06 ± 1.08 D
Volume 205.96 Å 3
Surface Area 192.89 Å 2
HOMO Energy -10.16 ± 0.55 eV
LUMO Energy -1.05 ± eV
Point Group Symmetry C1
Synonyms
  • (1s,6r)-3,7,7-trimethylbicyclo[4.1.0]hept-3-ene-2,5-quinone
InChIKey BBRJZZUFDYMNIY-HTQZYQBOSA-N
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