5-{(E)-[(2R)-2-Hydroxy-2,3-Dihydro-1H-Inden-1-Ylidene]Methyl}-1,3-Benzodioxole-4-Carboxylic Acid

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Properties Simple | Detailed

Formula C18H14O5
IUPAC Name 5-[(e)-[(2s)-2-hydroxyindan-1-ylidene]methyl]-1,3-benzodioxole-4-carboxylic acid
Molecular Mass 310.301 g·mol−1
Heat of Formation -557.6 ± 16.7 kJ·mol−1
Dipole Moment 1.46 ± 1.08 D
Volume 347.28 Å 3
Surface Area 305.13 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy -0.97 ± eV
Point Group Symmetry C1
InChIKey SLQGUUWKGRSNCG-GUNGLEHYSA-N
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