Carijodienone

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Properties Simple | Detailed

Formula C21H28O
IUPAC Name (3r,3ar,5as,6r,8as,8bs)-3',3a-dimethyl-3-vinyl-spiro[1,2,3,4,5,5a,7,8,8a,8b-decahydro-as-indacene-6,4'-cyclohexa-2,5-diene]-1'-one
Molecular Mass 296.446 g·mol−1
Heat of Formation -113.9 ± 16.7 kJ·mol−1
Dipole Moment 5.55 ± 1.08 D
Volume 401.21 Å 3
Surface Area 318.64 Å 2
HOMO Energy -9.77 ± 0.55 eV
LUMO Energy -0.38 ± eV
Point Group Symmetry C1
InChIKey WBURTZSEYTVSRX-OPJRWSFGSA-N
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Elements H C O