(1Ar,4R,4Ar,7Bs)-1,1,4,7-Tetramethyl-1,1A,2,3,4,4A,5,7B-Octahydro-6H-Cyclopropa[E]Azulen-6-One

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Properties Simple | Detailed

Formula C15H22O
IUPAC Name (1ar,4r,4ar,7bs)-1,1,4,7-tetramethyl-2,3,4,4a,5,7b-hexahydro-1ah-cyclopropa[e]azulen-6-one
Molecular Mass 218.335 g·mol−1
Heat of Formation -177.3 ± 16.7 kJ·mol−1
Dipole Moment 4.39 ± 1.08 D
Volume 297.37 Å 3
Surface Area 250.07 Å 2
HOMO Energy -9.32 ± 0.55 eV
LUMO Energy 3.15 ± eV
Point Group Symmetry C1
Synonyms
  • 6h-cycloprop(e)azulen-6-one, 1,1a,2,3,4,4a,5,7b-octahydro-1,1,4,7-tetramethyl-, (1ar-(1aalpha,4alpha,4abeta,7balpha))-
  • cyclocolorenone
CAS Number(s)
  • 489-45-2
InChIKey ZEEUIOBUKGZKPS-IDTAVKCVSA-N
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