6-Amino-9-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]-1-Methyl-Purine-3,7-Diium-6-Id-2-One

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Formula C11H16N5O5
IUPAC Name 6-amino-9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1-methyl-purine-3,7-diium-6-id-2-one
Molecular Mass 298.275 g·mol−1
Heat of Formation -674.2 ± 16.7 kJ·mol−1
Dipole Moment 7.48 ± 1.08 D
Volume 318.48 Å 3
Surface Area 282.01 Å 2
HOMO Energy -8.95 ± 0.55 eV
LUMO Energy 2.25 ± eV
Point Group Symmetry C1
InChIKey HPQCVIOTMVYJNL-KQYNXXCUSA-P
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