4-(2-Amino-6-Oxo-3H-Purine-1,9-Diium-5-Id-7-Yl)Butanal
Properties
| Property | Value |
|---|---|
| Formula | C9H18N5O2+ |
| IUPAC Name | 4-[(2s,4r,5s)-2-amino-6-oxo-2,3,4,5,8,9-hexahydro-1h-purin-3-ium-7-yl]butanal |
| Molecular Mass | 228.272 g·mol−1 |
| Heat of Formation | -73.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.36 ± 1.08 D |
| Volume | 252.95 Å 3 |
| Surface Area | 239.87 Å 2 |
| HOMO Energy | -9.15 ± 0.55 eV |
| LUMO Energy | -0.65 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KDGSSTZRAPCGBK-UHFFFAOYSA-O |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |