5-Fluoro-2-[1-(~3~H_3_)Methyl-1H-Pyrrolo[2,3-B]Pyridin-5-Yl][1,3]Oxazolo[5,4-B]Pyridine
Properties
Property | Value |
---|---|
Formula | C14H6FN4OT3 |
IUPAC Name | 5-fluoro-2-(1-methylpyrrolo[2,3-b]pyridin-7-ium-3a-id-5-yl)oxazolo[5,4-b]pyridine-1,4-diium |
Molecular Mass | 274.270 g·mol−1 |
Heat of Formation | 166.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.60 ± 1.08 D |
Volume | 289.28 Å 3 |
Surface Area | 275.95 Å 2 |
HOMO Energy | -9.13 ± 0.55 eV |
LUMO Energy | -1.66 ± eV |
Point Group Symmetry | Cs |
InChIKey | WYQHKOHCTMNFAU-UHFFFAOYSA-O |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
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Elements | H C N O F |