7-(6-Deoxy-β-D-Allofuranosyl)-3,7-Dihydro-6H-Purin-6-One
Properties
Property | Value |
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Formula | C11H14N4O5 |
IUPAC Name | 7-[(2r,3r,4s,5r)-3,4-dihydroxy-5-[(1r)-1-hydroxyethyl]tetrahydrofuran-2-yl]-3h-purin-6-one |
Molecular Mass | 282.253 g·mol−1 |
Heat of Formation | -664.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.35 ± 1.08 D |
Volume | 305.29 Å 3 |
Surface Area | 270.52 Å 2 |
HOMO Energy | -9.29 ± 0.55 eV |
LUMO Energy | 2.34 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | DQHCWWAARZMHKW-RWONEVQGSA-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 |