Info
| ID | 5898 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 0 |
| Donor atoms | {"N": 2} |
| Abbreviation | 9 |
| SMILES | COC(=O)c1ccc2c(c1)nc(-c1[c-]cccc1)n2Cc1ccccc1.Cc1c(C)c(C)[c-](C)c1C.[Cl-] |
TUCAN
C32H32IrN2O2/(1-33)(2-33)(3-33)(4-34)(5-34)(6-34)(7-35)(8-35)(9-35)(10-36)(11-59)(12-40)(13-39)(14-36)(15-36)(16-37)(17-46)(18-43)(19-44)(20-48)(21-50)(22-49)(23-63)(24-63)(25-63)(26-59)(27-37)(28-37)(29-41)(30-45)(31-42)(32-47)(33-51)(34-52)(35-53)(36-54)(37-56)(38-47)(38-57)(39-40)(39-43)(40-55)(41-42)(41-47)(42-45)(43-44)(44-46)(45-57)(46-55)(48-58)(48-60)(49-50)(49-58)(50-61)(51-52)(51-53)(52-54)(53-56)(54-56)(55-59)(57-62)(58-64)(59-65)(60-61)(60-66)(61-65)(62-65)(62-66)(63-68)(64-67)(64-68)(66-69)(68-69)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A2780 | 1.8 | — | 10.1039/c3cc46239k | 2013 |
| A2780cisR | 2.1 | — | 10.1039/c3cc46239k | 2013 |
| T47D | 2.3 | — | 10.1039/c3cc46239k | 2013 |
| HT-29 | 2.4 | — | 10.1039/c3cc46239k | 2013 |
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.