![[4,4'-Bis(tert-butyl)-2,2'-bipyridine]bis[3,5-difluoro-2-[5-(trifluoromethyl)-2-pyridinyl]phenyl]iridium(III) hexafluorophosphate](https://resource.bocsci.com/structure/870987-63-6.gif)
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| Related CAS: | 1992799-42-4 (Deleted CAS) 2136580-08-8 (Deleted CAS) 870987-62-5 (free base) |
| IUPAC Name: | 4-tert-butyl-2-(4-tert-butylpyridin-2-yl)pyridine;2-(2,4-difluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;ruthenium(3+);hexafluorophosphate |
| Description: | (Ir[dF(CF3)ppy]2(dtbpy))PF6 is a cyclometalated iridium(III) complex that can be used in visible-light mediated photocatalytic organic transformations. (Ir[dF(CF3)ppy]2(dtbpy))PF6 has been used to achieve late-stage incorporation of alkyl groups into a variety of biologically active heterocycles. |
| Molecular Weight: | 1121.91 |
| Molecular Formula: | C42H34F10IrN4.F6P |
| Canonical SMILES: | FC1=CC(F)=C2C3=CC=C(C=[N]3[Ir+3]45([C-]2=C1)([C-]6=CC(F)=CC(F)=C6C7=CC=C(C=[N]74)C(F)(F)F)[N]8=CC=C(C=C8C=9C=C(C=C[N]95)C(C)(C)C)C(C)(C)C)C(F)(F)F.[F-][P+5]([F-])([F-])([F-])([F-])[F-] |
| InChI: | InChI=1S/C18H24N2.2C12H5F5N.F6P.Ir/c1-17(2,3)13-7-9-19-15(11-13)16-12-14(8-10-20-16)18(4,5)6;2*13-8-2-3-9(10(14)5-8)11-4-1-7(6-18-11)12(15,16)17;1-7(2,3,4,5)6;/h7-12H,1-6H3;2*1-2,4-6H;;/q;3*-1;+3 |
| InChI Key: | XFAXYKCDJPDUTA-UHFFFAOYSA-N |
| Melting Point: | >300°C |
| Purity: | ≥95% |
| Solubility: | Soluble in Chloroform (Slightly) |
| Appearance: | Light Yellow to Yellow Solid |
| Storage: | Store at 2-8°C under inert gas (nitrogen or Argon) |
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