Methyl 5-Bromo-10-Hydroxy-8-Methyl-3,11-Dioxo-3,11-Dihydro-1H-Oxepino[4,3-B]Chromene-1-Carboxylate

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Formula C16H11BrO7
IUPAC Name methyl (1r)-5-bromo-10-hydroxy-8-methyl-3,11-dioxo-1h-oxepino[4,3-b]chromene-1-carboxylate
Molecular Mass 395.158 g·mol−1
Heat of Formation -902.2 ± 16.7 kJ·mol−1
Dipole Moment 7.45 ± 1.08 D
Volume 363.61 Å 3
Surface Area 319.3 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy -1.56 ± eV
Point Group Symmetry C1
InChIKey GHGYPOFJBFBJIY-OAHLLOKOSA-N
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Elements H C O Br