[(2R,3S,4R,5R)-5-(6-Amino-2-Fluoro-Purine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Phosphono Hydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C10H14FN5O10P2 |
IUPAC Name | [(2r,3s,4r,5r)-5-(6-amino-2-fluoro-purine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl phosphono hydrogen phosphate |
Molecular Mass | 445.192 g·mol−1 |
Heat of Formation | -2332.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.88 ± 1.08 D |
Volume | 428.27 Å 3 |
Surface Area | 364.97 Å 2 |
HOMO Energy | -9.34 ± 0.55 eV |
LUMO Energy | 1.60 ± eV |
Point Group Symmetry | C1 |
InChIKey | JNAGFEQGKIDIHA-UUOKFMHZSA-O |
QR Code | Generate QR Code |
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Elements | C F H O N P |