[(2R,3S,4R,5R)-5-(6-Aminopurin-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-[[[[(2R,3S,4R,5R)-5-(6-Aminopurin-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphinothioyl]Oxy-Hydroxy-Phosphoryl]Methyl]Phosphinic Acid
Properties
Property | Value |
---|---|
Formula | C21H33N10O14P3S |
IUPAC Name | [(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-[[[[(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-sulfanyl-phosphoryl]oxy-hydroxy-phosphoryl]methyl]phosphinic acid |
Molecular Mass | 774.532 g·mol−1 |
Heat of Formation | -2738.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.14 ± 1.08 D |
Volume | 768.95 Å 3 |
Surface Area | 609.65 Å 2 |
HOMO Energy | -9.03 ± 0.55 eV |
LUMO Energy | -1.19 ± eV |
Point Group Symmetry | C1 |
InChIKey | UJCWOSLCGXVJOD-LCHUORCTSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
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Elements | C H O N P S |