(2Xi)-Adenosine 5'-(Trihydrogen Diphosphate)

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Formula C10H15N5O10P2
IUPAC Name [(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl phosphono hydrogen phosphate
Molecular Mass 427.201 g·mol−1
Heat of Formation -2203.1 ± 16.7 kJ·mol−1
Dipole Moment 2.81 ± 1.08 D
Volume 413.32 Å 3
Surface Area 323.49 Å 2
HOMO Energy -9.22 ± 0.55 eV
LUMO Energy -1.39 ± eV
Point Group Symmetry C1
InChIKey XTWYTFMLZFPYCI-KMPDEGCQSA-N
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