(2R)-2-[(9-{(2R,3R,4S,5R)-3,4-Dihydroxy-5-[(Phosphonooxy)Methyl]Tetrahydro-2-Furanyl}-9H-Purin-6-Yl)Amino]-3-Phosphonopropanoic Acid
Properties
Property | Value |
---|---|
Formula | C13H19N5O12P2 |
IUPAC Name | (2r)-3-dihydroxyphosphoryl-2-[[9-[(2r,3r,4s,5r)-5-(dihydroxyphosphoryloxymethyl)-3,4-dihydroxy-tetrahydrofuran-2-yl]purin-6-yl]amino]propanoic acid |
Molecular Mass | 499.264 g·mol−1 |
Heat of Formation | -2490.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.99 ± 1.08 D |
Volume | 488.74 Å 3 |
Surface Area | 403.13 Å 2 |
HOMO Energy | -9.46 ± 0.55 eV |
LUMO Energy | -1.47 ± eV |
Point Group Symmetry | C1 |
InChIKey | FGKAJDFZKDATMR-DHVQZWLTSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | P C H O N |