Cinchonain Ia

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Formula C24H20O9
IUPAC Name (2r,3r,10r)-2,10-bis(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4,9,10-tetrahydro-2h-pyrano[2,3-h]chromen-8-one
Molecular Mass 452.410 g·mol−1
Heat of Formation -1364.4 ± 16.7 kJ·mol−1
Dipole Moment 3.99 ± 1.08 D
Volume 483.68 Å 3
Surface Area 381.19 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy -0.45 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,10r)-2,10-bis(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4,9,10-tetrahydro-2h-pyrano[6,5-h]chromen-8-one
  • cinchonain 1a
CAS Number(s)
  • 85081-24-9
InChIKey LKCOZWLUAKSRQM-UMAWSMADSA-N
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