[(2R,3S,4S)-5-(7,8-Dimethyl-4-Oxo-2-Thioxo-Benzo[G]Pteridine-1,5-Diium-9A-Id-10-Yl)-2,3,4-Trihydroxy-Pentyl] Dihydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C17H23N4O8PS++ |
| IUPAC Name | [(2r,3s,4s)-5-(7,8-dimethyl-4-oxo-2-thioxo-benzo[g]pteridine-1,5-diium-9a-id-10-yl)-2,3,4-trihydroxy-pentyl] dihydrogen phosphate |
| Molecular Mass | 474.425 g·mol−1 |
| Heat of Formation | -1491.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 11.01 ± 1.08 D |
| Volume | 500.6 Å 3 |
| Surface Area | 423.15 Å 2 |
| HOMO Energy | -8.62 ± 0.55 eV |
| LUMO Energy | -2.50 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QLLNAHUGZNFWPG-SCRDCRAPSA-P |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C H O N P S |