[(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-(2-Methyl-4H-Imidazol-1-Ium-4-Id-3-Yl)Phosphinic Acid

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Properties Simple | Detailed

Formula C14H20N7O7P+
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-(2-methyl-4h-imidazol-1-ium-4-id-3-yl)phosphinic acid
Molecular Mass 429.325 g·mol−1
Heat of Formation -1071.2 ± 16.7 kJ·mol−1
Dipole Moment 15.08 ± 1.08 D
Volume 451.91 Å 3
Surface Area 379.5 Å 2
HOMO Energy -9.14 ± 0.55 eV
LUMO Energy -0.67 ± eV
Point Group Symmetry C1
InChIKey YLZDAMUCCMGOQQ-QYVSTXNMSA-P
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