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

Molecule SVG Image

Properties Simple | Detailed

Formula C16H12BrO7+
IUPAC Name methyl (1r)-5-bromo-10-hydroxy-8-methyl-3,11-dioxo-1h-oxepino[4,3-b]chromen-6-ium-1-carboxylate
Molecular Mass 396.166 g·mol−1
Heat of Formation -902.2 ± 16.7 kJ·mol−1
Dipole Moment 7.62 ± 1.08 D
Volume 364.02 Å 3
Surface Area 319.25 Å 2
HOMO Energy -9.67 ± 0.55 eV
LUMO Energy 1.42 ± eV
Point Group Symmetry C1
InChIKey GHGYPOFJBFBJIY-OAHLLOKOSA-O
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O Br