Chloropuupehenone

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Formula C21H27ClO3
IUPAC Name (4as,6as,12ar,12bs)-11-chloro-10-hydroxy-4,4,6a,12b-tetramethyl-2,3,4a,5,6,12a-hexahydro-1h-benzo[a]xanthen-9-one
Molecular Mass 362.890 g·mol−1
Heat of Formation -551.7 ± 16.7 kJ·mol−1
Dipole Moment 7.15 ± 1.08 D
Volume 426.93 Å 3
Surface Area 336.2 Å 2
HOMO Energy -9.07 ± 0.55 eV
LUMO Energy -1.22 ± eV
Point Group Symmetry C1
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InChIKey IVURSJNKOFPQMR-GQSCTRQFSA-N
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Elements H C O Cl