α-L-Glucopyranosyl-(1->4)-α-L-Glycero-Hexopyranosyl-(1->3)-(3Xi)-D-Xylo-Hexitol

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Formula C18H34O16
IUPAC Name (2s,3r,4r,5r)-4-[(2s,3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxyhexane-1,2,3,5,6-pentol
Molecular Mass 506.453 g·mol−1
Heat of Formation -3036.1 ± 16.7 kJ·mol−1
Dipole Moment 10.33 ± 1.08 D
Volume 538.77 Å 3
Surface Area 407.35 Å 2
HOMO Energy -9.68 ± 0.55 eV
LUMO Energy 0.53 ± eV
Point Group Symmetry C1
InChIKey XJCCHWKNFMUJFE-ZAWRVPAISA-N
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Elements H C O