1-Deoxy-1-(7,8-Dimethyl-2,4-Dioxo-6-Thiocyanato-3,4-Dihydrobenzo[G]Pteridin-10(2H)-Yl)Pentitol
Properties
| Property | Value |
|---|---|
| Formula | C18H19N5O6S |
| IUPAC Name | [7,8-dimethyl-2,4-dioxo-10-[(2s,3s,4r)-2,3,4,5-tetrahydroxypentyl]benzo[g]pteridin-6-yl] thiocyanate |
| Molecular Mass | 433.438 g·mol−1 |
| Heat of Formation | -726.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.39 ± 1.08 D |
| Volume | 474.98 Å 3 |
| Surface Area | 399.75 Å 2 |
| HOMO Energy | -9.35 ± 0.55 eV |
| LUMO Energy | -2.31 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | FRZYWMHJCZJTRV-WDMOLILDSA-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 |