4-Amino-7-(4-Thio-β-D-Ribofuranosyl)-7H-Pyrrolo[2,3-D]Pyrimidine-5-Carbonitrile
Properties
| Property | Value |
|---|---|
| Formula | C12H13N5O3S |
| IUPAC Name | 4-amino-7-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrothiophen-2-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile |
| Molecular Mass | 307.328 g·mol−1 |
| Heat of Formation | -188.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.70 ± 1.08 D |
| Volume | 334.09 Å 3 |
| Surface Area | 296.64 Å 2 |
| HOMO Energy | -8.98 ± 0.55 eV |
| LUMO Energy | -0.94 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JVBNKTPGIUECFI-WOUKDFQISA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |