(2S,3Ar,3Bs,7R,7As)-2,6-Bis(Hydroxymethyl)-2,3B-Dimethyl-2,3,3A,3B,4,5,7,7A-Octahydro-1H-Cyclopenta[A]Pentalen-7-Ol

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Properties Simple | Detailed

Formula C15H24O3
IUPAC Name (3as,3br,5s,6as,7r)-1,5-bis(hydroxymethyl)-3a,5-dimethyl-3,3b,4,6,6a,7-hexahydro-2h-cyclopenta[a]pentalen-7-ol
Molecular Mass 252.349 g·mol−1
Heat of Formation -628.3 ± 16.7 kJ·mol−1
Dipole Moment 5.37 ± 1.08 D
Volume 324.56 Å 3
Surface Area 270.59 Å 2
HOMO Energy -9.56 ± 0.55 eV
LUMO Energy 0.58 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3ar,3bs,7r,7as)-2,3b-dimethyl-2,6-dimethylol-3,3a,4,5,7,7a-hexahydro-1h-cyclopenta[b]pentalen-7-ol
InChIKey RTRNIJJMGPYEML-JHOKLZQASA-N
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