2-Amino-9-(6-Deoxy-α-D-Talofuranosyl)-3,9-Dihydro-6H-Purin-6-One

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Formula C11H15N5O5
IUPAC Name 2-amino-9-[(2s,3s,4s,5r)-3,4-dihydroxy-5-[(1s)-1-hydroxyethyl]tetrahydrofuran-2-yl]-3,8-dihydropurine-1,2,4,5,7,8-hexaid-6-one
Molecular Mass 297.267 g·mol−1
Heat of Formation -648.5 ± 16.7 kJ·mol−1
Dipole Moment 9.87 ± 1.08 D
Volume 322.32 Å 3
Surface Area 283.89 Å 2
HOMO Energy -9.28 ± 0.55 eV
LUMO Energy -0.31 ± eV
Point Group Symmetry C1
InChIKey PYNVSZMFFVWFQA-BYMYQPSZSA-N
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