| Formula |
C25H16F2N4O3 |
| IUPAC Name |
1-(4-fluorophenyl)-n-(3-fluoro-4-pyrrolo[2,3-b]pyridin-1-ium-4-yloxy-phenyl)-2-oxo-pyridin-1-ium-3-ide-3-carboxamide |
| Molecular Mass |
458.416 g·mol−1 |
| Heat of Formation |
-336.8 ± 16.7 kJ·mol−1 |
| Dipole Moment |
7.90 ± 1.08 D |
| Volume |
491.54 Å 3 |
| Surface Area |
438.18 Å 2 |
| HOMO Energy |
-8.60 ± 0.55 eV |
| LUMO Energy |
1.44 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 1-(4-fluorophenyl)-n-[3-fluoro-4-(1h-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-2-keto-nicotinamide
- 1-(4-fluorophenyl)-n-[3-fluoro-4-(1h-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-2-oxo-3-pyridinecarboxamide
- 1-(4-fluorophenyl)-n-[3-fluoro-4-(1h-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-2-oxo-pyridine-3-carboxamide
|
| InChIKey |
OBSFXHDOLBYWRJ-UHFFFAOYSA-N |
| QR Code |
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| Links |
PubChem
ChemSpider
|
| DOI |
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| Downloads |
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|
| Elements |
H
C
F
O
N
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