1-(2-O-Methyl-β-D-Ribofuranosyl)-5,6-Dihydro-1H-Imidazo[4,5-D]Pyridazine-4,7-Dione

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Properties Simple | Detailed

Formula C11H14N4O6
IUPAC Name 1-[(2r,3r,4r,5r)-4-hydroxy-5-(hydroxymethyl)-3-methoxy-tetrahydrofuran-2-yl]-5,6-dihydroimidazo[4,5-d]pyridazin-3-ium-7a-ide-4,7-dione
Molecular Mass 298.252 g·mol−1
Heat of Formation -731.1 ± 16.7 kJ·mol−1
Dipole Moment 5.47 ± 1.08 D
Volume 318.79 Å 3
Surface Area 279.11 Å 2
HOMO Energy -9.50 ± 0.55 eV
LUMO Energy 1.80 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(2'-o-methyl-.beta.-d-ribofuranosyl)imidazo[4,5-d]pyridazin-4,7(5h, 6h)-dione
  • 1-[(2r,3r,4r,5r)-4-hydroxy-3-methoxy-5-methylol-tetrahydrofuran-2-yl]-5,6-dihydroimidazo[4,5-d]pyridazine-4,7-quinone
  • 1-[(2r,3r,4r,5r)-4-hydroxy-5-(hydroxymethyl)-3-methoxy-2-tetrahydrofuranyl]-5,6-dihydroimidazo[4,5-d]pyridazine-4,7-dione
  • 1-[(2r,3r,4r,5r)-4-hydroxy-5-(hydroxymethyl)-3-methoxy-oxolan-2-yl]-5,6-dihydroimidazo[4,5-d]pyridazine-4,7-dione
  • 1-[(2r,3r,4r,5r)-4-hydroxy-5-(hydroxymethyl)-3-methoxy-tetrahydrofuran-2-yl]-5,6-dihydroimidazo[4,5-d]pyridazine-4,7-dione
  • 1-[(2r,3r,4r,5r)-4-hydroxy-5-(hydroxymethyl)-3-methoxyoxolan-2-yl]-5,6-dihydroimidazo[4,5-d]pyridazine-4,7-dione
  • hmc-ho4
InChIKey SFMJBSIIVRJBCC-TZQXKBMNSA-N
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