[(2R,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-[[Hydroxy-[[(2R,3S,4R,5S)-3,4,5-Trihydroxytetrahydrofuran-2-Yl]Methoxy]Phosphoryl]Methyl]Phosphinic Acid
Properties
Property | Value |
---|---|
Formula | C16H27N5O13P2 |
IUPAC Name | [(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-[[hydroxy-[[(2r,3s,4r,5s)-3,4,5-trihydroxytetrahydrofuran-2-yl]methoxy]phosphoryl]methyl]phosphinic acid |
Molecular Mass | 559.359 g·mol−1 |
Heat of Formation | -2589.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.23 ± 1.08 D |
Volume | 562.06 Å 3 |
Surface Area | 473.99 Å 2 |
HOMO Energy | -9.14 ± 0.55 eV |
LUMO Energy | -0.60 ± eV |
Point Group Symmetry | C1 |
InChIKey | SZUIMWOHJOINLE-DBXCYWGHSA-O |
QR Code | Generate QR Code |
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Elements | P C H O N |