5-Hydroxy-2-(4-Oxidophenyl)-4-Oxo-4H-Chromen-7-Olate

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Formula C15H5D5O5
IUPAC Name 3,6,8-trideuterio-2-(3,5-dideuterio-4-hydroxy-phenyl)-5,7-dihydroxy-chromen-4-one
Molecular Mass 275.268 g·mol−1
Heat of Formation -650.3 ± 16.7 kJ·mol−1
Dipole Moment 3.48 ± 1.08 D
Volume 290.83 Å 3
Surface Area 271.17 Å 2
HOMO Energy -9.41 ± 0.55 eV
LUMO Energy -1.36 ± eV
Point Group Symmetry C1
InChIKey KZNIFHPLKGYRTM-UHFFFAOYSA-O
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Elements H C O