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

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Formula C6H20O30P8
IUPAC Name [(1r,3s,4s,6s)-3-[hydroxy(phosphonooxy)phosphoryl]oxy-2,4,5,6-tetraphosphonooxy-cyclohexyl] phosphono hydrogen phosphate
Molecular Mass 819.995 g·mol−1
Heat of Formation -8082.8 ± 16.7 kJ·mol−1
Dipole Moment 5.14 ± 1.08 D
Volume 697.0 Å 3
Surface Area 504.34 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy -1.81 ± eV
Point Group Symmetry C1
InChIKey HHQOOERQSFJGEP-ZSIQDKGESA-N
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