(2S,3S,4R,5R)-5-(6-Amino-2-Isobutyl-Purine-1,3,7-Triium-9-Yl)-2-(Hydroxymethyl)-4-Sulfanyl-Tetrahydrofuran-3-Ol
Properties
| Property | Value |
|---|---|
| Formula | C14H21N5O3S |
| IUPAC Name | (2s,3s,4r,5r)-5-(6-amino-2-isobutyl-purine-1,3,7-triium-9-yl)-2-(hydroxymethyl)-4-sulfanyl-tetrahydrofuran-3-ol |
| Molecular Mass | 339.413 g·mol−1 |
| Heat of Formation | -406.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.09 ± 1.08 D |
| Volume | 398.08 Å 3 |
| Surface Area | 334.25 Å 2 |
| HOMO Energy | -9.08 ± 0.55 eV |
| LUMO Energy | 2.30 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BGPRNYXGTRQPRR-DWBRFPOHSA-O |
| QR Code | Generate QR Code |
| Links | |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |