[(2R,3S,5R)-5-(2-Amino-6-Ethoxy-Purine-1,3,7-Triium-9-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate

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Formula C12H19N5O7P
IUPAC Name [(2r,3s,5r)-5-(2-amino-6-ethoxy-purine-1,3,7-triium-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 376.282 g·mol−1
Heat of Formation -1330.4 ± 16.7 kJ·mol−1
Dipole Moment 5.19 ± 1.08 D
Volume 388.23 Å 3
Surface Area 351.03 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy 2.73 ± eV
Point Group Symmetry C1
InChIKey MARHPQLWZLIZRV-XLPZGREQSA-O
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