N,N-Diethyl-2-{2-[3-(~125~I)Iodo-4-Methoxyphenyl]-5,7-Dimethylpyrazolo[1,5-A]Pyrimidin-3-Yl}Acetamide
Properties
| Property | Value |
|---|---|
| Formula | C21H25IN4O2 |
| IUPAC Name | n,n-diethyl-2-[2-(3-iodo-4-methoxy-phenyl)-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-4-ium-3-id-3-yl]acetamide |
| Molecular Mass | 490.353 g·mol−1 |
| Heat of Formation | 1.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.63 ± 1.08 D |
| Volume | 496.82 Å 3 |
| Surface Area | 400.61 Å 2 |
| HOMO Energy | -8.41 ± 0.55 eV |
| LUMO Energy | -0.54 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | TYBYEGAEDKDDES-ONBQKKEBSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | I H C O N |