5-Amino-3-Pentofuranosyl-2,3-Dihydro-7H-[1,2,3]Triazolo[4,5-D]Pyrimidin-7-One
Properties
| Property | Value |
|---|---|
| Formula | C9H12N6O5 |
| IUPAC Name | (5s)-5-amino-3-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2,3a,4,5,6,7a-hexahydro-1h-triazolo[4,5-d]pyrimidin-7-one |
| Molecular Mass | 284.229 g·mol−1 |
| Heat of Formation | 601.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 13.90 ± 1.08 D |
| Volume | 257.49 Å 3 |
| Surface Area | 246.15 Å 2 |
| HOMO Energy | -9.55 ± 0.55 eV |
| LUMO Energy | -3.39 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | PFIXFNFIQKRYHC-KBDBTLMNSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C O N |