(1R,3S,4R,5S,6R)-2,4,5,6-Tetrakis(Phosphonooxy)-1,3-Cyclohexanediyl Bis[Trihydrogen (Diphosphate)]

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Formula C6H20O30P8
IUPAC Name [(1r,3s,4r,6r)-3-[hydroxy(phosphonooxy)phosphoryl]oxy-2,4,5,6-tetraphosphonooxy-cyclohexyl] phosphono hydrogen phosphate
Molecular Mass 819.995 g·mol−1
Heat of Formation -8135.4 ± 16.7 kJ·mol−1
Dipole Moment 5.79 ± 1.08 D
Volume 688.53 Å 3
Surface Area 478.49 Å 2
HOMO Energy -9.65 ± 0.55 eV
LUMO Energy -1.46 ± eV
Point Group Symmetry C1
InChIKey HHQOOERQSFJGEP-SLWYWOEDSA-N
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