| Formula |
C9H16N5O10P3 |
| IUPAC Name |
[(1r)-2-(6-aminopurine-1,3,7-triium-9-yl)-1-methyl-ethoxy]methyl-[hydroxy(phosphonooxy)phosphoryl]oxy-phosphinic acid |
| Molecular Mass |
447.172 g·mol−1 |
| Heat of Formation |
-2504.7 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.60 ± 1.08 D |
| Volume |
431.18 Å 3 |
| Surface Area |
334.94 Å 2 |
| HOMO Energy |
-8.79 ± 0.55 eV |
| LUMO Energy |
1.85 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
DMNLURSRCCFDHR-ZCFIWIBFSA-O |
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| DOI |
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|
| Elements |
P
C
H
O
N
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