4-Hydroxy-3-(2-Hydroxy-3-Oxo-1-Phenylbutyl)-2H-Chromen-2-One

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Properties Simple | Detailed

Formula C19H16O5
IUPAC Name 4-hydroxy-3-[(1r,2s)-2-hydroxy-3-oxo-1-phenyl-butyl]chromen-2-one
Molecular Mass 324.327 g·mol−1
Heat of Formation -660.6 ± 16.7 kJ·mol−1
Dipole Moment 2.42 ± 1.08 D
Volume 362.47 Å 3
Surface Area 316.16 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy 2.01 ± eV
Point Group Symmetry C1
InChIKey BPZSPAZBZFZZBN-NVXWUHKLSA-N
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Elements H C O