N6-Methyl-2-Phenylethynyladenosine
Properties
Property | Value |
---|---|
Formula | C19H19N5O4 |
IUPAC Name | (2r,3s,4r,5r)-2-(hydroxymethyl)-5-[6-(methylamino)-2-(2-phenylethynyl)purine-1,3,7-triium-9-yl]tetrahydrofuran-3,4-diol |
Molecular Mass | 381.385 g·mol−1 |
Heat of Formation | -94.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 0.62 ± 1.08 D |
Volume | 432.25 Å 3 |
Surface Area | 392.48 Å 2 |
HOMO Energy | -8.65 ± 0.55 eV |
LUMO Energy | -0.96 ± eV |
Point Group Symmetry | C1 |
InChIKey | QPMWMOJXQPUBBF-OYWVLEMYSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |