(2-{[(1S,2R,3R,4R,5S,6S)-4-(Benzyloxy)-2,3,5,6-Tetrakis(Phosphonooxy)Cyclohexyl]Oxy}-2-Oxoethyl)Phosphonic Acid

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Formula C15H25O22P5
IUPAC Name [2-[(2r,3r,5s,6s)-4-benzyloxy-2,3,5,6-tetraphosphonooxy-cyclohexoxy]-2-oxo-ethyl]phosphonic acid
Molecular Mass 712.215 g·mol−1
Heat of Formation -5503.9 ± 16.7 kJ·mol−1
Dipole Moment 4.32 ± 1.08 D
Volume 667.07 Å 3
Surface Area 492.99 Å 2
HOMO Energy -9.56 ± 0.55 eV
LUMO Energy -0.43 ± eV
Point Group Symmetry C1
InChIKey KVXFVNYXADEMDE-FYYZZUKCSA-N
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