2-Hydroxy-5-[5-Hydroxy-4-Oxo-7-(Sulfooxy)-4H-Chromen-2-Yl]Phenyl Hydrogen Sulfate

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Properties Simple | Detailed

Formula C15H11O12S2+
IUPAC Name [2-hydroxy-5-(5-hydroxy-4-oxo-7-sulfooxy-chromen-2-yl)phenyl] hydrogen sulfate
Molecular Mass 447.371 g·mol−1
Heat of Formation -1794.8 ± 16.7 kJ·mol−1
Dipole Moment 3.45 ± 1.08 D
Volume 420.85 Å 3
Surface Area 377.57 Å 2
HOMO Energy -9.58 ± 0.55 eV
LUMO Energy -1.31 ± eV
Point Group Symmetry C1
InChIKey WFETZDMFLGONLW-UHFFFAOYSA-N
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