Mgk Repellent 11

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Formula C13H16O2
IUPAC Name (4as,5as,9as,9bs)-4,5a,6,9,9a,9b-hexahydro-1h-dibenzofuran-4a-carbaldehyde
Molecular Mass 204.265 g·mol−1
Heat of Formation -224.2 ± 16.7 kJ·mol−1
Dipole Moment 2.56 ± 1.08 D
Volume 252.52 Å 3
Surface Area 220.85 Å 2
HOMO Energy -9.56 ± 0.55 eV
LUMO Energy 0.52 ± eV
Point Group Symmetry C1
Synonyms
  • (4as,5as,9as,9bs)-4,5a,6,9,9a,9b-hexahydro-1h-dibenzofuran-4a-carbaldehyde
  • (4as,5as,9as,9bs)-4,5a,6,9,9a,9b-hexahydro-1h-dibenzofuran-4a-carboxaldehyde
InChIKey XNYGOEGATLFFOX-ZDEQEGDKSA-N
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