Abieta-8,11,13-Trien-18-Al

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Formula C20H28O
IUPAC Name (1r,4as,10ar)-7-isopropyl-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carbaldehyde
Molecular Mass 284.436 g·mol−1
Heat of Formation -249.6 ± 16.7 kJ·mol−1
Dipole Moment 2.56 ± 1.08 D
Volume 378.68 Å 3
Surface Area 314.27 Å 2
HOMO Energy -9.07 ± 0.55 eV
LUMO Energy 0.40 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,4as,10ar)-1,2,3,4,4a,9,10,10a-octahydro-7-isopropyl-1,4a -dimethylphenanthrene-1-carbaldehyde
  • (1r,4as,10ar)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carbaldehyde
  • (1r,4as,10ar)-7-isopropyl-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carbaldehyde
  • (1r,4as,10ar)-7-isopropyl-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxaldehyde
InChIKey YCLCHPWRGSDZKL-SLFFLAALSA-N
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