(R)-[(2S,3R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-[Hydroxy(Phosphonooxy)Phosphoryl]Oxy-Sulfido-Phosphonium

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Properties Simple | Detailed

Formula C10H17N5O11P3S
IUPAC Name (r)-[(2s,3r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxy-sulfido-phosphonium
Molecular Mass 508.255 g·mol−1
Heat of Formation -2704.5 ± 16.7 kJ·mol−1
Dipole Moment 2.29 ± 1.08 D
Volume 484.17 Å 3
Surface Area 376.46 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy -1.45 ± eV
Point Group Symmetry C1
InChIKey VRVCZFKGDMBPIK-PMDYSDCVSA-O
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