9-[(2R,5S)-2-(Hydroxymethyl)-1,3-Oxathiolan-5-Yl]-3,9-Dihydro-6H-Purin-6-One
Properties
Property | Value |
---|---|
Formula | C9H10N4O3S |
IUPAC Name | 9-[(2r,5s)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-3,8-dihydro-2h-purine-1,2,4,5,7,8-hexaid-6-one |
Molecular Mass | 254.266 g·mol−1 |
Heat of Formation | -203.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 12.75 ± 1.08 D |
Volume | 266.97 Å 3 |
Surface Area | 237.38 Å 2 |
HOMO Energy | -8.98 ± 0.55 eV |
LUMO Energy | 1.61 ± eV |
Point Group Symmetry | C1 |
InChIKey | NWAMVXFWUIMGLW-NTSWFWBYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
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Elements | H S C O N |