(2R,3R,4R,5R)-5-(6-Amino-2-Hex-1-Ynyl-Purine-1,3,7-Triium-9-Yl)-N-Ethyl-3,4-Dihydroxy-Tetrahydrofuran-2-Carboxamide
Properties
| Property | Value |
|---|---|
| Formula | C18H24N6O4 |
| IUPAC Name | (2r,3r,4r,5r)-5-(6-amino-2-hex-1-ynyl-purine-1,3,7-triium-9-yl)-n-ethyl-3,4-dihydroxy-tetrahydrofuran-2-carboxamide |
| Molecular Mass | 388.421 g·mol−1 |
| Heat of Formation | -331.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.07 ± 1.08 D |
| Volume | 463.16 Å 3 |
| Surface Area | 407.12 Å 2 |
| HOMO Energy | -8.96 ± 0.55 eV |
| LUMO Energy | 2.24 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YYGWUZLAGGREJN-UHQDVWGKSA-O |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |