[(2R,3S,4R,5R)-5-(2-Amino-6-Oxo-3H-Purine-1,7-Diium-4-Id-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-(4H-Imidazol-1-Ium-4-Id-3-Yl)Phosphinic Acid

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Formula C13H18N7O7P
IUPAC Name [(2r,3s,4r,5r)-5-(2-amino-6-oxo-3h-purine-1,7-diium-4-id-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-(4h-imidazol-1-ium-4-id-3-yl)phosphinic acid
Molecular Mass 415.298 g·mol−1
Heat of Formation -1079.4 ± 16.7 kJ·mol−1
Dipole Moment 12.05 ± 1.08 D
Volume 423.92 Å 3
Surface Area 347.98 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy -0.99 ± eV
Point Group Symmetry C1
InChIKey VEHNVGSUJIEZNI-WOUKDFQISA-P
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