(2R)-2-[[9-[(2R,3R,4R,5R)-3,4-Dihydroxy-5-(Phosphonooxymethyl)Tetrahydrofuran-2-Yl]Purine-1,3,7-Triium-6-Yl]Amino]Butanedioic Acid
Properties
Property | Value |
---|---|
Formula | C14H18N5O11P |
IUPAC Name | (2r)-2-[[9-[(2r,3r,4r,5r)-3,4-dihydroxy-5-(phosphonooxymethyl)tetrahydrofuran-2-yl]purine-1,3,7-triium-6-yl]amino]butanedioic acid |
Molecular Mass | 463.293 g·mol−1 |
Heat of Formation | -2106.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.28 ± 1.08 D |
Volume | 467.0 Å 3 |
Surface Area | 389.54 Å 2 |
HOMO Energy | -9.39 ± 0.55 eV |
LUMO Energy | -1.26 ± eV |
Point Group Symmetry | C1 |
InChIKey | LFGKDYDHJAGJMG-BLXDLRLXSA-O |
QR Code | Generate QR Code |
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Elements | P C H O N |