[(2R,3S,4R,5R)-5-(5-Amino-7-Oxo-Triazolo[4,5-D]Pyrimidine-2,3,4,6-Tetraium-3-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate

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Formula C9H15N6O8P
IUPAC Name [(2r,3s,4r,5r)-5-(5-amino-7-oxo-triazolo[4,5-d]pyrimidine-2,3,4,6-tetraium-3-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 366.225 g·mol−1
Heat of Formation -1228.5 ± 16.7 kJ·mol−1
Dipole Moment 6.15 ± 1.08 D
Volume 360.63 Å 3
Surface Area 306.5 Å 2
HOMO Energy -9.76 ± 0.55 eV
LUMO Energy -1.67 ± eV
Point Group Symmetry C1
InChIKey GHDPOCOABRFYPM-XUHIHXAHSA-O
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