N~8~-Butyl-9-Pentofuranosyl-9H-Purine-6,8-Diamine

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Formula C14H22N6O4
IUPAC Name (2s,3s,4s,5r)-2-[6-amino-8-(butylamino)purin-9-ium-8-ylium-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
Molecular Mass 338.362 g·mol−1
Heat of Formation -553.2 ± 16.7 kJ·mol−1
Dipole Moment 5.31 ± 1.08 D
Volume 390.99 Å 3
Surface Area 343.87 Å 2
HOMO Energy -8.52 ± 0.55 eV
LUMO Energy -0.47 ± eV
Point Group Symmetry C1
InChIKey OQQOFNMNLZCUPG-PZWLIILKSA-N
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