9-(α-D-Ribofuranosyl)-3,9-Dihydro-1H-Purine-2,6-Dione

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Properties Simple | Detailed

Formula C10H12N4O6
IUPAC Name 9-[(2s,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3,8-dihydropurine-4,5,7,8-tetraide-2,6-dione
Molecular Mass 284.225 g·mol−1
Heat of Formation -885.3 ± 16.7 kJ·mol−1
Dipole Moment 7.95 ± 1.08 D
Volume 292.53 Å 3
Surface Area 263.87 Å 2
HOMO Energy -9.51 ± 0.55 eV
LUMO Energy 2.34 ± eV
Point Group Symmetry C1
Synonyms
  • 9-[(2s,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-3h-purine-2,6-dione
  • 9-[(2s,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3h-purine-2,6-dione
  • 9-[(2s,3r,4s,5r)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]xanthine
  • xts
InChIKey UBORTCNDUKBEOP-BDXYJKHTSA-N
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