(2R,3R,4R,5S)-2-(6-Aminopurine-1,3,7-Triium-9-Yl)-5-[[(2R)-2-Oxo-1,2Λ5-Oxaphosphiran-2-Yl]Oxymethyl]Tetrahydrofuran-3,4-Diol; [(E)-6-(4-Hydroxy-6-Methoxy-7-Methyl-3-Oxo-1H-Isobenzofuran-5-Yl)-4-Methyl-Hex-4-Enoxy]-Oxido-Oxo-Phosphonium
Properties
| Property | Value |
|---|---|
| Formula | C28H35N5O13P2 |
| IUPAC Name | (2r,3r,4r,5s)-2-(6-aminopurine-1,3,7-triium-9-yl)-5-[[(2r)-2-oxo-1,2λ5-oxaphosphiran-2-yl]oxymethyl]tetrahydrofuran-3,4-diol; [(e)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1h-isobenzofuran-5-yl)-4-methyl-hex-4-enoxy]-oxido-oxo-phosphonium |
| Molecular Mass | 711.551 g·mol−1 |
| Heat of Formation | -2319.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.66 ± 1.08 D |
| Volume | 771.37 Å 3 |
| Surface Area | 502.38 Å 2 |
| HOMO Energy | -8.96 ± 0.55 eV |
| LUMO Energy | -0.79 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JYOQCPTYPPEAJC-RIFVUCJDSA-O |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |