(2S,3S,4R,5R)-5-(6-Amino-2-Hex-1-Ynyl-Purine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Carboxamide
Properties
| Property | Value |
|---|---|
| Formula | C16H20N6O4 |
| IUPAC Name | (2s,3s,4r,5r)-5-(6-amino-2-hex-1-ynyl-purine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-carboxamide |
| Molecular Mass | 360.368 g·mol−1 |
| Heat of Formation | -290.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.33 ± 1.08 D |
| Volume | 409.79 Å 3 |
| Surface Area | 371.04 Å 2 |
| HOMO Energy | -8.78 ± 0.55 eV |
| LUMO Energy | -0.60 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ASJORKBLTHKOFZ-MEQWQQMJSA-O |
| QR Code | Generate QR Code |
| Links | |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |