Info
| ID | 5112 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 2} |
| Abbreviation | Ir5 |
| SMILES | CC(C)c1cccc(C(C)C)c1/N=C/c1ccccn1.Cc1c(C)c(C)[c-](C)c1C.[Cl-] |
TUCAN
C28H37IrN2/(1-38)(2-38)(3-38)(4-39)(5-39)(6-39)(7-40)(8-40)(9-40)(10-41)(11-43)(12-43)(13-43)(14-44)(15-60)(16-44)(17-44)(18-61)(19-51)(20-52)(21-45)(22-45)(23-45)(24-46)(25-50)(26-46)(27-46)(28-62)(29-41)(30-41)(31-49)(32-42)(33-47)(34-42)(35-48)(36-42)(37-63)(38-53)(39-54)(40-55)(41-56)(42-57)(43-60)(44-60)(45-61)(46-61)(47-48)(47-62)(48-49)(49-64)(50-51)(50-52)(51-58)(52-59)(53-54)(53-55)(54-56)(55-57)(56-57)(58-60)(58-65)(59-61)(59-65)(62-66)(63-64)(63-67)(64-66)(65-67)(66-68)(67-68)
Measurements (6)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | 6.9 | — | 10.1039/c9dt00259f | 2019 |
| BEAS-2B | 6.9 | — | 10.1039/c9dt00259f | 2019 |
| HepG2 | 12 | — | 10.1039/c9dt00259f | 2019 |
| HeLa | 14 | — | 10.1039/C7DT03265J | 2017 |
| A549 | 20 | — | 10.1039/c9dt00259f | 2019 |
| A549 | 29 | — | 10.1039/C7DT03265J | 2017 |
Source-assisted 2D generator
Builds the drawing from source ligand graphs and explicit donor metadata, then uses Metal2D only for layout. Publication output uses black bonds without arrows or colour highlighting; validated octahedral enantiomers are encoded directly with solid and hashed wedge bonds.
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The generated SVG will appear here. The legacy ligand image above stays visible for side-by-side review.