1-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]-4-Oxo-Pyrazolo[3,4-D]Pyrimidine-1,2,5,7-Tetraium-3-Carbothioamide

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Formula C11H15N5O5S
IUPAC Name 1-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4-oxo-pyrazolo[3,4-d]pyrimidine-1,2,5,7-tetraium-3-carbothioamide
Molecular Mass 329.332 g·mol−1
Heat of Formation -461.9 ± 16.7 kJ·mol−1
Dipole Moment 5.21 ± 1.08 D
Volume 336.65 Å 3
Surface Area 286.51 Å 2
HOMO Energy -9.28 ± 0.55 eV
LUMO Energy -2.09 ± eV
Point Group Symmetry C1
InChIKey ADHKWSZPXNPLAW-DIQMVPLZSA-O
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