[(1R,2S,4R)-4-(6-Aminopurine-1,3,7-Triium-9-Yl)-2-Hydroxy-Cyclopentyl]Methyl Dihydrogen Phosphate

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Formula C11H16N5O5P
IUPAC Name [(1r,2s,4r)-4-(6-aminopurine-1,3,7-triium-9-yl)-2-hydroxy-cyclopentyl]methyl dihydrogen phosphate
Molecular Mass 329.249 g·mol−1
Heat of Formation -1011.1 ± 16.7 kJ·mol−1
Dipole Moment 1.99 ± 1.08 D
Volume 348.26 Å 3
Surface Area 307.86 Å 2
HOMO Energy -8.99 ± 0.55 eV
LUMO Energy 2.55 ± eV
Point Group Symmetry C1
InChIKey WGQJKDYIDJWXFC-PRJMDXOYSA-O
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