2-Amino-9-[(2-Hydroxy-2-Oxo-1,3,2Λ5-Dioxaphosphinan-5-Yl)Oxymethyl]-3H-Purine-1,7-Diium-4-Id-6-One

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Formula C9H13N5O6P
IUPAC Name 2-amino-9-[(2-hydroxy-2-oxo-1,3,2λ5-dioxaphosphinan-5-yl)oxymethyl]-3h-purine-1,7-diium-4-id-6-one
Molecular Mass 318.203 g·mol−1
Heat of Formation -1018.5 ± 16.7 kJ·mol−1
Dipole Moment 14.73 ± 1.08 D
Volume 324.0 Å 3
Surface Area 286.02 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy -0.34 ± eV
Point Group Symmetry C1
InChIKey MKWGXKNYQBSLPL-UHFFFAOYSA-P
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