(9R,9'S)-4,4',5,5'-Tetrahydroxy-10,10'-Dioxo-9,9',10,10'-Tetrahydro-9,9'-Bianthracene-2,2'-Dicarboxylic Acid

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Properties Simple | Detailed

Formula C30H18O10
IUPAC Name (9s)-9-[(9r)-2-carboxy-4,5-dihydroxy-10-oxo-9h-anthracen-9-yl]-4,5-dihydroxy-10-oxo-9h-anthracene-2-carboxylic acid
Molecular Mass 538.458 g·mol−1
Heat of Formation -1492.9 ± 16.7 kJ·mol−1
Dipole Moment 0.02 ± 1.08 D
Volume 563.43 Å 3
Surface Area 426.79 Å 2
HOMO Energy -9.53 ± 0.55 eV
LUMO Energy 1.14 ± eV
Point Group Symmetry Ci
Synonyms
  • (9s)-9-[(9r)-2-carboxy-4,5-dihydroxy-10-keto-9h-anthracen-9-yl]-4,5-dihydroxy-10-keto-9h-anthracene-2-carboxylic acid
InChIKey JPMRHWLJLNKRTJ-SZPZYZBQSA-N
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