[(2R,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl [(2R,3R,4R,5R)-2-(6-Aminopurine-1,3,7-Triium-9-Yl)-4-Hydroxy-5-(Hydroxymethyl)Tetrahydrofuran-3-Yl] Hydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C20H25N10O10P |
IUPAC Name | [(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl [(2r,3r,4r,5r)-2-(6-aminopurine-1,3,7-triium-9-yl)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-3-yl] hydrogen phosphate |
Molecular Mass | 596.447 g·mol−1 |
Heat of Formation | -1542.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.94 ± 1.08 D |
Volume | 615.54 Å 3 |
Surface Area | 421.11 Å 2 |
HOMO Energy | -8.93 ± 0.55 eV |
LUMO Energy | -0.59 ± eV |
Point Group Symmetry | C1 |
InChIKey | WMNNNWTUOTUFMZ-XPWFQUROSA-P |
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Elements | P C H O N |