N-(2-Furylmethyl)-7-(β-D-Ribofuranosyl)-7H-Pyrrolo[2,3-D]Pyrimidin-4-Amine

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Formula C16H18N4O5
IUPAC Name (2r,3r,4r,5s)-2-[4-(2-furylmethylamino)pyrrolo[2,3-d]pyrimidin-7-ium-7-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
Molecular Mass 346.338 g·mol−1
Heat of Formation -522.2 ± 16.7 kJ·mol−1
Dipole Moment 4.94 ± 1.08 D
Volume 386.38 Å 3
Surface Area 348.74 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy 2.65 ± eV
Point Group Symmetry C1
InChIKey YLYCSUFVQKCZCW-BCUIYNNISA-N
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