5-Hydroxy-2,8-Dimethyl-6,9-Dihydro-4H-Oxepino[3,2-G]Chromen-4-One

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Properties Simple | Detailed

Formula C15H14O4
IUPAC Name 5-hydroxy-2,8-dimethyl-6,9-dihydropyrano[3,2-h][1]benzoxepin-4-one
Molecular Mass 258.269 g·mol−1
Heat of Formation -539.2 ± 16.7 kJ·mol−1
Dipole Moment 4.32 ± 1.08 D
Volume 291.64 Å 3
Surface Area 268.57 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy -0.93 ± eV
Point Group Symmetry C1
InChIKey IUIHYYSAVUBPQO-UHFFFAOYSA-O
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Elements H C O