(2R,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6S)-6-(2-Chloro-4-Nitro-Phenoxy)-4,5-Dihydroxy-2-(Hydroxymethyl)Tetrahydropyran-3-Yl]Oxy-6-(Hydroxymethyl)Tetrahydropyran-3,4,5-Triol

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Formula C18H24ClNO13
IUPAC Name (2r,3r,4s,5s,6r)-2-[(2r,3s,4r,5r,6s)-6-(2-chloro-4-nitro-phenoxy)-4,5-dihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl]oxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
Molecular Mass 497.835 g·mol−1
Heat of Formation -1999.5 ± 16.7 kJ·mol−1
Dipole Moment 7.63 ± 1.08 D
Volume 519.76 Å 3
Surface Area 401.4 Å 2
HOMO Energy -10.29 ± 0.55 eV
LUMO Energy -1.59 ± eV
Point Group Symmetry C1
InChIKey KYDVWHLZWZQBRI-YMJSIHPXSA-N
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Elements H C N O Cl