(1Xi)-1-(5-Amino-7-Oxo-2,7-Dihydropyrazolo[3,4-E][1,3]Oxazin-3-Yl)-1,4-Anhydro-D-Ribitol

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Formula C10H12N4O6
IUPAC Name 5-amino-3-[(2s,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2h-pyrazolo[3,4-e][1,3]oxazin-7-one
Molecular Mass 284.225 g·mol−1
Heat of Formation -721.2 ± 16.7 kJ·mol−1
Dipole Moment 5.41 ± 1.08 D
Volume 296.69 Å 3
Surface Area 270.25 Å 2
HOMO Energy -10.10 ± 0.55 eV
LUMO Energy -0.74 ± eV
Point Group Symmetry C1
InChIKey LEOBQDISFVFUFQ-BITYOTRTSA-O
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