5-Methyl-1-(β-L-Xylofuranosyl)-1,5-Dihydro-1,4,5,6,8-Pentaazaacenaphthylen-3-Amine

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Formula C13H16N6O4
IUPAC Name (2s,3s,4s,5s)-2-(5-amino-7-methyl-2,6,7,9,11-pentazatricyclo[6.3.1.04,12]dodeca-1(12),3,5,8,10-pentaen-2-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
Molecular Mass 320.304 g·mol−1
Heat of Formation -282.4 ± 16.7 kJ·mol−1
Dipole Moment 5.75 ± 1.08 D
Volume 342.74 Å 3
Surface Area 301.08 Å 2
HOMO Energy -7.96 ± 0.55 eV
LUMO Energy -0.37 ± eV
Point Group Symmetry C1
Synonyms
  • 0
  • 1
  • 4
  • 7
  • c
  • g
  • n
InChIKey HOGVTUZUJGHKPL-DUWABBFASA-N
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