1-Deoxy-1-(7,8-Dimethyl-2,4-Dioxo-6-Thioxo-1,3,4,6-Tetrahydrobenzo[G]Pteridin-10(2H)-Yl)Pentitol
Properties
| Property | Value |
|---|---|
| Formula | C17H20N4O6S |
| IUPAC Name | (10s)-7,8-dimethyl-10-[(2s,3s,4s)-2,3,4,5-tetrahydroxypentyl]-6-thioxo-1h-benzo[g]pteridin-5-ium-10a-ide-2,4-dione |
| Molecular Mass | 408.429 g·mol−1 |
| Heat of Formation | 1294.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 13.81 ± 1.08 D |
| Volume | 444.09 Å 3 |
| Surface Area | 353.64 Å 2 |
| HOMO Energy | -9.24 ± 0.55 eV |
| LUMO Energy | -0.85 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | XWPMQSWESYKPEA-GBIKHYSHSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | S C O N |