(+)-Heptelidic Acid

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Formula C15H20O5
IUPAC Name (5ar,6s,9r,9as)-6-isopropyl-1-oxo-spiro[3,5a,6,7,8,9a-hexahydro-2-benzoxepine-9,2'-oxirane]-4-carboxylic acid
Molecular Mass 280.316 g·mol−1
Heat of Formation -793.9 ± 16.7 kJ·mol−1
Dipole Moment 4.76 ± 1.08 D
Volume 331.12 Å 3
Surface Area 280.93 Å 2
HOMO Energy -10.37 ± 0.55 eV
LUMO Energy 2.29 ± eV
Point Group Symmetry C1
InChIKey JESMSCGUTIEROV-OHTBPHCPSA-N
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