(5S)-5-Hydroxy-1,7-Bis(4-Hydroxy-3-Methoxyphenyl)-3-Heptanone

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Properties Simple | Detailed

Formula C21H26O6
IUPAC Name (5s)-5-hydroxy-1,7-bis(4-hydroxy-3-methoxy-phenyl)heptan-3-one
Molecular Mass 374.428 g·mol−1
Heat of Formation -936.4 ± 16.7 kJ·mol−1
Dipole Moment 2.85 ± 1.08 D
Volume 454.06 Å 3
Surface Area 419.6 Å 2
HOMO Energy -8.47 ± 0.55 eV
LUMO Energy -0.02 ± eV
Point Group Symmetry C1
InChIKey RSAHICAPUYTWHW-INIZCTEOSA-N
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