7-{(3S)-2-Hydroperoxy-4-Methoxy-3-[(Methoxycarbonyl)Amino]-4-Oxobutyl}-4,6-Dimethyl-3-(β-D-Ribofuranosyl)-3,4-Dihydro-9H-Imidazo[1,2-A]Purin-9-One
Properties
Property | Value |
---|---|
Formula | C21H28N6O11 |
IUPAC Name | 7-{(3s)-2-hydroperoxy-4-methoxy-3-[(methoxycarbonyl)amino]-4-oxobutyl}-4,6-dimethyl-3-(beta-d-ribofuranosyl)-3,4-dihydro-9h-imidazo[1,2-a]purin-9-one |
Molecular Mass | 540.481 g·mol−1 |
Heat of Formation | 794.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.10 ± 1.08 D |
Volume | 594.2 Å 3 |
Surface Area | 521.2 Å 2 |
HOMO Energy | -8.99 ± 0.55 eV |
LUMO Energy | -2.08 ± eV |
Point Group Symmetry | C1 |
InChIKey | WCNMEQDMUYVWMJ-ADLSKWGTSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C O N |