(3As,6As)-Hexahydro-1(2H)-Pentalenone

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Properties Simple | Detailed

Formula C8H12O
IUPAC Name (3as,6as)-3,3a,4,5,6,6a-hexahydro-2h-pentalen-1-one
Molecular Mass 124.180 g·mol−1
Heat of Formation -242.5 ± 16.7 kJ·mol−1
Dipole Moment 3.19 ± 1.08 D
Volume 164.6 Å 3
Surface Area 162.44 Å 2
HOMO Energy -9.92 ± 0.55 eV
LUMO Energy 3.99 ± eV
Point Group Symmetry C1
Synonyms
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  • a
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InChIKey NZTVVUIIJPWANB-BQBZGAKWSA-N
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Elements H C O