2',5-Dihydroxy-6,7-Methylenedioxyisoflavone

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Properties Simple | Detailed

Formula C16H11O6+
IUPAC Name 9-hydroxy-7-(2-hydroxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one
Molecular Mass 299.255 g·mol−1
Heat of Formation -671.4 ± 16.7 kJ·mol−1
Dipole Moment 3.61 ± 1.08 D
Volume 310.64 Å 3
Surface Area 282.81 Å 2
HOMO Energy -9.02 ± 0.55 eV
LUMO Energy 2.96 ± eV
Point Group Symmetry C1
InChIKey ITRQVDOUFMSYII-UHFFFAOYSA-O
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