5-(6-Aminopurin-9-Yl)-2-(Hydroxymethyl)-4-(4-Nitrophenyl)Tetrahydrofuran-3-Ol

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Formula C16H16N6O5
IUPAC Name (2s,3r,4s,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-2-(hydroxymethyl)-4-(4-nitrophenyl)tetrahydrofuran-3-ol
Molecular Mass 372.335 g·mol−1
Heat of Formation -207.6 ± 16.7 kJ·mol−1
Dipole Moment 4.38 ± 1.08 D
Volume 395.66 Å 3
Surface Area 331.48 Å 2
HOMO Energy -9.22 ± 0.55 eV
LUMO Energy 1.66 ± eV
Point Group Symmetry C1
InChIKey SYSQXFJVTDHGLI-DDFXLWFNSA-N
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