N-(3-Methyl-2-Buten-1-Yl)-5'-O-Phosphonatoadenosine
Properties
Property | Value |
---|---|
Formula | C15H22N5O7P |
IUPAC Name | [(2r,3s,4r,5r)-3,4-dihydroxy-5-[6-(3-methylbut-2-enylamino)purin-9-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate |
Molecular Mass | 415.338 g·mol−1 |
Heat of Formation | -1340.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 9.65 ± 1.08 D |
Volume | 448.52 Å 3 |
Surface Area | 382.3 Å 2 |
HOMO Energy | -8.89 ± 0.55 eV |
LUMO Energy | -0.59 ± eV |
Point Group Symmetry | C1 |
InChIKey | DUISZFLWBAPRBR-APAOZMKASA-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 |