9-[5-O-(2-Oxido-1,3,2-Oxazaphosphinan-2-Yl)-β-D-Arabinofuranosyl]-9H-Purin-6-Amine

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Properties Simple | Detailed

Formula C13H19N6O6P
IUPAC Name (2r,3s,4s,5r)-2-(6-aminopurin-9-yl)-5-[[(2s)-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]oxymethyl]tetrahydrofuran-3,4-diol
Molecular Mass 386.300 g·mol−1
Heat of Formation -1009.3 ± 16.7 kJ·mol−1
Dipole Moment 5.88 ± 1.08 D
Volume 409.31 Å 3
Surface Area 340.28 Å 2
HOMO Energy -8.99 ± 0.55 eV
LUMO Energy -0.72 ± eV
Point Group Symmetry C1
InChIKey FWPLWRROPGYURV-LCKYEWHMSA-N
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