4-O-(6-O-Phosphonato-α-D-Glucopyranosyl)-α-D-Glucopyranose

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Properties Simple | Detailed

Formula C12H24O14P
IUPAC Name trioxido-[[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[(2r,3s,4r,5r,6s)-4,5,6-trihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl]oxy-tetrahydropyran-2-yl]methoxy]phosphonium
Molecular Mass 423.284 g·mol−1
Heat of Formation -2597.5 ± 16.7 kJ·mol−1
Dipole Moment 3.28 ± 1.08 D
Volume 425.73 Å 3
Surface Area 338.57 Å 2
HOMO Energy -10.36 ± 0.55 eV
LUMO Energy 2.47 ± eV
Point Group Symmetry C1
InChIKey ITPHOIFCAFNCLL-ASMJPISFSA-L
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