Methyl 7,8,9-Trihydroxy-3,5-Dioxo-1,2,3,5-Tetrahydrocyclopenta[C]Isochromene-1-Carboxylate

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Properties Simple | Detailed

Formula C14H11O8+
IUPAC Name methyl (1r)-7,8,9-trihydroxy-3,5-dioxo-1,2-dihydrocyclopenta[c]isochromene-1-carboxylate
Molecular Mass 307.232 g·mol−1
Heat of Formation -1158.8 ± 16.7 kJ·mol−1
Dipole Moment 6.56 ± 1.08 D
Volume 312.56 Å 3
Surface Area 279.68 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy 1.56 ± eV
Point Group Symmetry C1
InChIKey JNWDNAASYHRXMG-RXMQYKEDSA-N
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Elements H C O