2-(1,3-Benzodioxol-5-Yl)-4H-Chromen-4-One

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Properties Simple | Detailed

Formula C16H11O4+
IUPAC Name 2-(1,3-benzodioxol-5-yl)chromen-4-one
Molecular Mass 267.256 g·mol−1
Heat of Formation -294.7 ± 16.7 kJ·mol−1
Dipole Moment 4.60 ± 1.08 D
Volume 291.0 Å 3
Surface Area 271.84 Å 2
HOMO Energy -9.20 ± 0.55 eV
LUMO Energy 1.97 ± eV
Point Group Symmetry C1
InChIKey XJKWXDPKDNEEKV-UHFFFAOYSA-O
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