[(2R,3S,4R,5R)-3,4-Dihydroxy-5-[6-(Methylamino)-8H-Purin-9-Ium-8-Ylium-9-Yl]Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C11H16N5O7P |
| IUPAC Name | [(2r,3s,4r,5r)-3,4-dihydroxy-5-[6-(methylamino)-8h-purin-9-ium-8-ylium-9-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate |
| Molecular Mass | 361.248 g·mol−1 |
| Heat of Formation | -1305.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.65 ± 1.08 D |
| Volume | 370.85 Å 3 |
| Surface Area | 336.45 Å 2 |
| HOMO Energy | -8.96 ± 0.55 eV |
| LUMO Energy | -0.57 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | WTIMTAUHUYTNGZ-IOSLPCCCSA-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 |