[(3S)-4-Hydroxy-3-{[(4-Oxo-4,5-Dihydro-1H-Pyrrolo[3,2-D]Pyrimidin-7-Yl)Methyl]Amino}Butyl]Phosphonic Acid

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Formula C11H17N4O5P
IUPAC Name [(3s)-4-hydroxy-3-[(4-oxo-1h-pyrrolo[3,2-d]pyrimidine-3,5-diium-7a-ylium-7-yl)methylamino]butyl]phosphonic acid
Molecular Mass 316.250 g·mol−1
Heat of Formation -998.8 ± 16.7 kJ·mol−1
Dipole Moment 5.90 ± 1.08 D
Volume 352.15 Å 3
Surface Area 299.34 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy 2.85 ± eV
Point Group Symmetry C1
InChIKey YYXVNWBGVIIBOW-QMMMGPOBSA-N
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