2-Amino-9-[(9S,10S,11R,12R,13R,14R,15R,16R,44S,45R)-16-(6-Amino-8H-Purin-9-Ium-8-Ylium-9-Yl)-11,12,44,45-Tetrahydroxy-44,45-Dioxo-38,39,40,41,42,43-Hexaoxa-44Λ5,45Λ5-Diphosphatricyclo[Blah.Blah.Blah.Blah]Octadecan-15-Yl]Purine-1,9-Diium-6-One
Properties
| Property | Value |
|---|---|
| Formula | C20H26N10O13P2+ |
| IUPAC Name | 2-amino-9-[(9s,10s,11r,12r,13r,14r,15r,16r,44s,45r)-16-(6-amino-8h-purin-9-ium-8-ylium-9-yl)-11,12,44,45-tetrahydroxy-44,45-dioxo-38,39,40,41,42,43-hexaoxa-44λ5,45λ5-diphosphatricyclo[blah.blah.blah.blah]octadecan-15-yl]purine-1,9-diium-6-one |
| Molecular Mass | 676.427 g·mol−1 |
| Heat of Formation | -2348.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.78 ± 1.08 D |
| Volume | 666.97 Å 3 |
| Surface Area | 543.23 Å 2 |
| HOMO Energy | -9.10 ± 0.55 eV |
| LUMO Energy | -0.98 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AOQJCASUCNXOMA-OIFWLNRKSA-Q |
| QR Code | Generate QR Code |
| Links | |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |