3-(2,4-Dihydroxyphenyl)-5-Hydroxy-4-Oxo-7-Chromanolate

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Properties Simple | Detailed

Formula C15H11O6-
IUPAC Name 3-(2,4-dihydroxyphenyl)-7-hydroxy-4-oxo-2,3-dihydrochromen-5-olate
Molecular Mass 287.244 g·mol−1
Heat of Formation 947.9 ± 16.7 kJ·mol−1
Dipole Moment 6.76 ± 1.08 D
Volume 288.1 Å 3
Surface Area 266.35 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy -2.77 ± eV
Point Group Symmetry C1
InChIKey WNHXBLZBOWXNQO-JTQLQIEISA-M
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Elements C O