2-[(9Ar)-2,7-Dimethyl-9A,10-Dihydro-5H-Pyrimido[4,5-D][1,3]Thiazolo[3,2-A]Pyrimidin-8-Yl]Ethyl Trihydrogen Diphosphate
Properties
| Property | Value |
|---|---|
| Formula | C12H18N4O7P2S |
| IUPAC Name | 2-[(9ar)-2,7-dimethyl-9a,10-dihydro-5h-pyrimido[4,5-d][1,3]thiazolo[3,2-a]pyrimidin-8-yl]ethyl trihydrogen diphosphate |
| Molecular Mass | 424.306 g·mol−1 |
| Heat of Formation | -1715.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.84 ± 1.08 D |
| Volume | 438.57 Å 3 |
| Surface Area | 371.5 Å 2 |
| HOMO Energy | -8.30 ± 0.55 eV |
| LUMO Energy | -1.50 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YMICAUCZSWITQD-GFCCVEGCSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C H O N P S |