| Formula |
C25H18FN7O |
| IUPAC Name |
2-[5-[3-(benzimidazol-1-ium-2-yl)indazol-1-ium-3-ylium-6-yl]-4h-pyrazol-2-ium-4-id-3-yl]-n-(3-fluorophenyl)acetamide |
| Molecular Mass |
451.455 g·mol−1 |
| Heat of Formation |
388.6 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.62 ± 1.08 D |
| Volume |
498.75 Å 3 |
| Surface Area |
455.73 Å 2 |
| HOMO Energy |
-8.60 ± 0.55 eV |
| LUMO Energy |
2.12 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
XLSVGNQXTNEETK-UHFFFAOYSA-N |
| QR Code |
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| Links |
ChemSpider
|
| DOI |
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| Downloads |
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|
| Elements |
H
C
N
O
F
|
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