4-Amino-7-[(2S,3S,5R)-3-Hydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]Pyrrolo[2,3-D]Pyrimidine-1,3-Diium-4A-Ide-5-Carboxamide
Properties
| Property | Value |
|---|---|
| Formula | C12H15N5O4 |
| IUPAC Name | 4-amino-7-[(2s,3s,5r)-3-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrrolo[2,3-d]pyrimidine-1,3-diium-4a-ide-5-carboxamide |
| Molecular Mass | 293.279 g·mol−1 |
| Heat of Formation | -543.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.34 ± 1.08 D |
| Volume | 322.12 Å 3 |
| Surface Area | 284.28 Å 2 |
| HOMO Energy | -8.75 ± 0.55 eV |
| LUMO Energy | -0.61 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NYGLSXNHOGCLFE-GBWPEJGWSA-O |
| QR Code | Generate QR Code |
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| Elements | H C O N |