[(2R,3R,4R,5R)-2-(6-Aminopurine-1,3,7-Triium-9-Yl)-4-Hydroxy-5-(Phosphonooxymethyl)Tetrahydrofuran-3-Yl] 2-Aminobenzoate
Properties
Property | Value |
---|---|
Formula | C17H19N6O8P |
IUPAC Name | [(2r,3r,4r,5r)-2-(6-aminopurine-1,3,7-triium-9-yl)-4-hydroxy-5-(phosphonooxymethyl)tetrahydrofuran-3-yl] 2-aminobenzoate |
Molecular Mass | 466.342 g·mol−1 |
Heat of Formation | -1371.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.38 ± 1.08 D |
Volume | 483.78 Å 3 |
Surface Area | 409.65 Å 2 |
HOMO Energy | -8.85 ± 0.55 eV |
LUMO Energy | -0.63 ± eV |
Point Group Symmetry | C1 |
InChIKey | SEQGIXAEYMTMQU-XNIJJKJLSA-O |
QR Code | Generate QR Code |
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Elements | P C H O N |