4-{[(2,3-Dihydroxypropoxy)(Hydroxy)Phosphoryl]Oxy}-2,3,5,6-Tetrahydroxycyclohexyl Dihydrogen Phosphate

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Formula C9H20O14P2
IUPAC Name [(2r)-2,3-dihydroxypropyl] [(2s,3s,5r,6s)-2,3,5,6-tetrahydroxy-4-phosphonooxy-cyclohexyl] hydrogen phosphate
Molecular Mass 414.194 g·mol−1
Heat of Formation -3271.4 ± 16.7 kJ·mol−1
Dipole Moment 3.91 ± 1.08 D
Volume 398.63 Å 3
Surface Area 327.49 Å 2
HOMO Energy -10.05 ± 0.55 eV
LUMO Energy -0.81 ± eV
Point Group Symmetry C1
InChIKey MRHAWIJFXZJZEV-PWWBNTJWSA-N
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