(1R,2S,4S,5S)-3,6-Dihydroxy-1,2,4,5-Cyclohexanetetrayl Tetrakis[Dihydrogen (Phosphate)]

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Properties Simple | Detailed

Formula C6H16O18P4
IUPAC Name [(1r,3r,4r,6r)-2,5-dihydroxy-3,4,6-triphosphonooxy-cyclohexyl] dihydrogen phosphate
Molecular Mass 500.075 g·mol−1
Heat of Formation -4600.1 ± 16.7 kJ·mol−1
Dipole Moment 2.53 ± 1.08 D
Volume 432.73 Å 3
Surface Area 345.65 Å 2
HOMO Energy -9.80 ± 0.55 eV
LUMO Energy -0.57 ± eV
Point Group Symmetry C1
Synonyms
  • [(1r,3r,4r,6r)-2,5-dihydroxy-3,4,6-triphosphonooxy-cyclohexyl] dihydrogen phosphate
  • [(1r,3r,4r,6r)-2,5-dihydroxy-3,4,6-triphosphonooxycyclohexyl] dihydrogen phosphate
InChIKey ZAWIXNGTTZTBKV-CTBIGQHSSA-N
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