[(1S,2R,3S,4R,5S)-2-(6-Amino-2-Chloro-Purine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-5-Bicyclo[3.1.0]Hexanyl]Methyl Dihydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C12H15ClN5O6P |
| IUPAC Name | [(1s,2r,3s,4r,5s)-2-(6-amino-2-chloro-purine-1,3,7-triium-9-yl)-3,4-dihydroxy-5-bicyclo[3.1.0]hexanyl]methyl dihydrogen phosphate |
| Molecular Mass | 391.704 g·mol−1 |
| Heat of Formation | -832.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.44 ± 1.08 D |
| Volume | 394.86 Å 3 |
| Surface Area | 348.82 Å 2 |
| HOMO Energy | -9.27 ± 0.55 eV |
| LUMO Energy | 2.16 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OOKYGBRIEMAHJA-OFVUKCMBSA-O |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C Cl H O N P |