[(2R,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-4-Hydroxy-3-Phosphonooxy-Tetrahydrofuran-2-Yl]Methyl Sulfo Hydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C10H15N5O13P2S |
IUPAC Name | [(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-4-hydroxy-3-phosphonooxy-tetrahydrofuran-2-yl]methyl sulfo hydrogen phosphate |
Molecular Mass | 507.264 g·mol−1 |
Heat of Formation | -2726.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.52 ± 1.08 D |
Volume | 465.79 Å 3 |
Surface Area | 375.5 Å 2 |
HOMO Energy | -9.23 ± 0.55 eV |
LUMO Energy | -1.26 ± eV |
Point Group Symmetry | C1 |
InChIKey | VZUCNYCWESXBTN-KQYNXXCUSA-O |
QR Code | Generate QR Code |
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Elements | C H O N P S |