(3As,4S,6Ar)-4-(5-{1-[4-(6-Amino-9H-Purin-9-Yl)Butyl]-1H-1,2,3-Triazol-4-Yl}Pentyl)Tetrahydro-1H-Thieno[3,4-D]Imidazol-2(3H)-One
Properties
| Property | Value |
|---|---|
| Formula | C21H30N10OS |
| IUPAC Name | (3as,4s,6ar)-4-[5-[1-[4-(6-aminopurin-9-yl)butyl]triazol-4-yl]pentyl]-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-2-one |
| Molecular Mass | 470.594 g·mol−1 |
| Heat of Formation | 163.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.18 ± 1.08 D |
| Volume | 566.1 Å 3 |
| Surface Area | 427.4 Å 2 |
| HOMO Energy | -8.79 ± 0.55 eV |
| LUMO Energy | -0.42 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | GCOZLSRXMOWRSO-ULQDDVLXSA-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 |