9-{2-Deoxy-5-O-[Hydroxy(Oxido)Phosphoranyl]Pentofuranosyl}-9H-Purin-2-Amine

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Formula C10H4N5O5P
IUPAC Name 2-[3-[(5e)-4-cyano-5-cyanoimino-2h-imidazole-1-carbonyl]oxiren-2-yl]ethynoxy-oxido-oxo-phosphonium
Molecular Mass 305.143 g·mol−1
Heat of Formation 429.0 ± 16.7 kJ·mol−1
Dipole Moment 11.74 ± 1.08 D
Volume 306.34 Å 3
Surface Area 296.51 Å 2
HOMO Energy -9.47 ± 0.55 eV
LUMO Energy -2.48 ± eV
Point Group Symmetry C1
InChIKey XHZLYOLDUZBSPU-UHFFFAOYSA-N
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