2-Amino-9-[(9R,10R,11R,12R,13S,14R,15R,16R,44R,45S)-15-(6-Amino-8H-Purin-9-Ium-8-Ylium-3,6-Diid-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-16-Yl]Purine-3,9-Diium-6-One
Properties
| Property | Value |
|---|---|
| Formula | C20H28N10O13P2+ |
| IUPAC Name | 2-amino-9-[(9r,10r,11r,12r,13s,14r,15r,16r,44r,45s)-15-(6-amino-8h-purin-9-ium-8-ylium-3,6-diid-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-16-yl]purine-3,9-diium-6-one |
| Molecular Mass | 678.443 g·mol−1 |
| Heat of Formation | -2295.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 9.75 ± 1.08 D |
| Volume | 650.35 Å 3 |
| Surface Area | 486.16 Å 2 |
| HOMO Energy | -9.14 ± 0.55 eV |
| LUMO Energy | -1.28 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | IMRXYAZHWTVTRW-INFSMZHSSA-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 |