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

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Properties Simple | Detailed

Formula C10H17N5O11P3S
IUPAC Name [[[(2r,3s,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-dihydroxy-sulfido-phosphonium
Molecular Mass 508.255 g·mol−1
Heat of Formation -2695.0 ± 16.7 kJ·mol−1
Dipole Moment 5.62 ± 1.08 D
Volume 479.75 Å 3
Surface Area 371.5 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy -1.55 ± eV
Point Group Symmetry C1
InChIKey XWOCUPDJPVWFMH-RRKCRQDMSA-O
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