9-[5-S-(2-Aminoethyl)-5-Thio-β-L-Lyxofuranosyl]-N-(4-Nitrobenzyl)-9H-Purin-6-Amine
Properties
| Property | Value |
|---|---|
| Formula | C19H23N7O5S |
| IUPAC Name | (2r,3s,4r,5s)-2-(2-aminoethylsulfanylmethyl)-5-[6-[(4-nitrophenyl)methylamino]purine-1,3,7-triium-9-yl]tetrahydrofuran-3,4-diol |
| Molecular Mass | 461.495 g·mol−1 |
| Heat of Formation | -182.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.92 ± 1.08 D |
| Volume | 508.02 Å 3 |
| Surface Area | 436.39 Å 2 |
| HOMO Energy | -8.59 ± 0.55 eV |
| LUMO Energy | -1.83 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OAFPVFZXWPVEBS-PSLQGDIJSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O N |