N-(3-Methyl-2-Buten-1-Yl)-2-(Methylsulfanyl)-9-Pentofuranosyl-9H-Purin-6-Amine
Properties
| Property | Value |
|---|---|
| Formula | C16H23N5O4S |
| IUPAC Name | (2r,3s,4s,5s)-2-(hydroxymethyl)-5-[6-(3-methylbut-2-enylamino)-2-methylsulfanyl-purin-9-ium-9-yl]tetrahydrofuran-3,4-diol |
| Molecular Mass | 381.450 g·mol−1 |
| Heat of Formation | -512.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.94 ± 1.08 D |
| Volume | 440.85 Å 3 |
| Surface Area | 381.91 Å 2 |
| HOMO Energy | -8.50 ± 0.55 eV |
| LUMO Energy | 2.44 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | VZQXUWKZDSEQRR-NYMYIZQJSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |