[(2R,3Ar,4R,6R,6Ar)-4-(6-Aminopurine-1,3,7-Triium-9-Yl)-2-Hydroxy-2-Oxo-3A,4,6,6A-Tetrahydrofuro[3,4-D][1,3,2]Dioxaphosphol-6-Yl]Methanol

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Formula C10H14N5O6P
IUPAC Name [(2r,3ar,4r,6r,6ar)-4-(6-aminopurine-1,3,7-triium-9-yl)-2-hydroxy-2-oxo-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-6-yl]methanol
Molecular Mass 331.222 g·mol−1
Heat of Formation -1068.7 ± 16.7 kJ·mol−1
Dipole Moment 2.19 ± 1.08 D
Volume 326.91 Å 3
Surface Area 286.33 Å 2
HOMO Energy -9.14 ± 0.55 eV
LUMO Energy -0.96 ± eV
Point Group Symmetry C1
InChIKey DZJNFKNMZRWRRR-KQYNXXCUSA-O
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