(5S,6R)-5,6-Dihydroxy-3-Methoxy-2,5-Bis(4-Methoxyphenyl)-2-Cyclohexen-1-One

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Properties Simple | Detailed

Formula C21H22O6
IUPAC Name (5s,6r)-5,6-dihydroxy-3-methoxy-2,5-bis(4-methoxyphenyl)cyclohex-2-en-1-one
Molecular Mass 370.396 g·mol−1
Heat of Formation -784.3 ± 16.7 kJ·mol−1
Dipole Moment 4.03 ± 1.08 D
Volume 425.9 Å 3
Surface Area 367.85 Å 2
HOMO Energy -8.69 ± 0.55 eV
LUMO Energy -0.03 ± eV
Point Group Symmetry C1
Synonyms
  • (5s,6r)-5,6-dihydroxy-3-methoxy-2,5-bis(4-methoxyphenyl)-1-cyclohex-2-enone
  • (5s,6r)-5,6-dihydroxy-3-methoxy-2,5-bis(4-methoxyphenyl)cyclohex-2-en-1-one
InChIKey GZSCQNISHIIIPB-SFTDATJTSA-N
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Elements H C O