N~2~-Phenyl-9-(β-D-Xylofuranosyl)-9H-Purine-2,6-Diamine
Properties
Property | Value |
---|---|
Formula | C16H18N6O4 |
IUPAC Name | (2r,3r,4r,5r)-2-(6-amino-2-anilino-purin-9-ium-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol |
Molecular Mass | 358.352 g·mol−1 |
Heat of Formation | -351.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.49 ± 1.08 D |
Volume | 396.41 Å 3 |
Surface Area | 345.21 Å 2 |
HOMO Energy | -8.41 ± 0.55 eV |
LUMO Energy | -0.40 ± eV |
Point Group Symmetry | C1 |
InChIKey | SCNILGOVBBRMBK-JDTTZNEISA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |