(2R,5S)-5-Amino-2-[[(2S,3R,4R,5R)-5-(6-Aminopurin-9-Ium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl]-2-Ethyl-Blahcyclohexan-6-One
Properties
| Property | Value |
|---|---|
| Formula | C16H24N6O5S |
| IUPAC Name | (2r,5s)-5-amino-2-[[(2s,3r,4r,5r)-5-(6-aminopurin-9-ium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl]-2-ethyl-blahcyclohexan-6-one |
| Molecular Mass | 412.464 g·mol−1 |
| Heat of Formation | -633.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.54 ± 1.08 D |
| Volume | 457.31 Å 3 |
| Surface Area | 367.63 Å 2 |
| HOMO Energy | -8.76 ± 0.55 eV |
| LUMO Energy | -0.87 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZFKLRXWXKVQZJN-IXCNWUDHSA-O |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |