Methyl 2-Chloro-1,8-Dihydroxy-9-Oxo-1,3A,9,9A-Tetrahydrocyclopenta[B]Chromene-1-Carboxylate

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Formula C14H11ClO6
IUPAC Name methyl (1r,3as,9ar)-2-chloro-1,8-dihydroxy-9-oxo-3a,9a-dihydrocyclopenta[b]chromene-1-carboxylate
Molecular Mass 310.687 g·mol−1
Heat of Formation -882.7 ± 16.7 kJ·mol−1
Dipole Moment 1.04 ± 1.08 D
Volume 319.97 Å 3
Surface Area 270.23 Å 2
HOMO Energy -9.24 ± 0.55 eV
LUMO Energy -0.91 ± eV
Point Group Symmetry C1
InChIKey JYCCBDSKURVFFQ-FDLBOYPASA-N
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Elements H C O Cl