[(1S)-1-[(6-Aminopurine-1,3,7-Triium-9-Yl)Methyl]-2-Hydroxy-Ethoxy]Methylphosphonic Acid

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Properties Simple | Detailed

Formula C9H14N5O5P
IUPAC Name [(1s)-1-[(6-aminopurine-1,3,7-triium-9-yl)methyl]-2-hydroxy-ethoxy]methylphosphonic acid
Molecular Mass 303.212 g·mol−1
Heat of Formation -916.6 ± 16.7 kJ·mol−1
Dipole Moment 4.80 ± 1.08 D
Volume 324.8 Å 3
Surface Area 273.92 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy -0.83 ± eV
Point Group Symmetry C1
InChIKey BUUUEODHGWQDDY-LURJTMIESA-O
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