9H-Purine-6-Thiol, 2-Amino-9-(2-Deoxy-.α.-D-Erythro-Pentofuranosyl)-

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Formula C10H14N5O3S
IUPAC Name 2-amino-9-[(2r,4r,5s)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3h-purine-1,7-diium-4-ide-6-thione
Molecular Mass 284.315 g·mol−1
Heat of Formation -192.6 ± 16.7 kJ·mol−1
Dipole Moment 11.81 ± 1.08 D
Volume 308.11 Å 3
Surface Area 277.08 Å 2
HOMO Energy -7.82 ± 0.55 eV
LUMO Energy 2.19 ± eV
Point Group Symmetry C1
InChIKey SCVJRXQHFJXZFZ-NGJCXOISSA-P
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