(3As,3Br)-3A-Hydroxy-2,2,3B-Trimethyl-4-Methylene-3,3A,3B,4-Tetrahydro-1H-Cyclopenta[A]Pentalene-1,5(2H)-Dione

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Properties Simple | Detailed

Formula C15H16O3
IUPAC Name (3ar,3bs)-3b-hydroxy-3a,5,5-trimethyl-3-methylene-4h-cyclopenta[a]pentalene-2,6-dione
Molecular Mass 244.286 g·mol−1
Heat of Formation -284.0 ± 16.7 kJ·mol−1
Dipole Moment 2.89 ± 1.08 D
Volume 300.59 Å 3
Surface Area 253.6 Å 2
HOMO Energy -10.07 ± 0.55 eV
LUMO Energy -1.36 ± eV
Point Group Symmetry C1
Synonyms
  • (3as,3br)-3a-hydroxy-2,2,3b-trimethyl-4-methylene-3h-cyclopenta[f]pentalene-1,5-dione
  • (3as,3br)-3a-hydroxy-2,2,3b-trimethyl-4-methylene-3h-cyclopenta[f]pentalene-1,5-quinone
  • (3as,3br)-3a-hydroxy-2,2,3b-trimethyl-4-methylidene-3h-cyclopenta[f]pentalene-1,5-dione
InChIKey JHGIQUYJFHGGCR-LSDHHAIUSA-N
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Elements H C O