6-(3,5-Difluoroanilino)-9-Ethyl-Purine-2-Carbonitrile
Properties
Property | Value |
---|---|
Formula | C14H10F2N6 |
IUPAC Name | 6-(3,5-difluoroanilino)-9-ethyl-purine-1,3,7-triium-2-carbonitrile |
Molecular Mass | 300.266 g·mol−1 |
Heat of Formation | 1878.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.15 ± 1.08 D |
Volume | 324.01 Å 3 |
Surface Area | 313.82 Å 2 |
HOMO Energy | -9.71 ± 0.55 eV |
LUMO Energy | -3.33 ± eV |
Point Group Symmetry | C1 |
InChIKey | SZYYBVWPURUFRR-UHFFFAOYSA-O |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C F N |