(3Z)-3-(3,4-Dihydroxybenzylidene)-6-[(E)-2-(4-Hydroxy-3-Methoxyphenyl)Vinyl]-2-Methoxy-2-Methyl-2,3-Dihydro-4H-Furo[3,2-C]Pyran-4-One

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Properties Simple | Detailed

Formula C25H23O8+
IUPAC Name (2r,3z)-3-[(3,4-dihydroxyphenyl)methylene]-6-[(e)-2-(4-hydroxy-3-methoxy-phenyl)vinyl]-2-methoxy-2-methyl-furo[3,2-c]pyran-4-one
Molecular Mass 451.445 g·mol−1
Heat of Formation -964.0 ± 16.7 kJ·mol−1
Dipole Moment 7.46 ± 1.08 D
Volume 510.52 Å 3
Surface Area 447.07 Å 2
HOMO Energy -8.71 ± 0.55 eV
LUMO Energy -1.34 ± eV
Point Group Symmetry C1
InChIKey XCJITIROISCLRT-GJLOCCQTSA-N
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Elements H C O