Info
| ID | 4878 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 5} |
| Abbreviation | [1b]Cl |
| SMILES | Fc1c[c-]c(-c2ccccn2)c(F)c1.Fc1c[c-]c(-c2ccccn2)c(F)c1.O=C(Cn1c(-c2cscn2)nc2ccccc21)c1ccccc1 |
TUCAN
C40H25F4IrN5OS/(1-35)(2-42)(3-40)(4-37)(5-41)(6-50)(7-32)(8-31)(9-46)(10-65)(11-28)(12-29)(13-33)(14-44)(15-39)(16-64)(17-52)(18-38)(19-52)(20-30)(21-36)(22-51)(23-34)(24-43)(25-45)(26-43)(26-48)(27-45)(27-49)(28-35)(28-37)(29-41)(29-54)(30-36)(30-39)(31-60)(31-61)(32-35)(32-47)(33-62)(33-63)(34-46)(34-55)(36-40)(37-38)(38-47)(39-57)(40-56)(41-42)(42-50)(43-61)(44-46)(44-51)(45-63)(47-59)(48-54)(48-60)(49-55)(49-62)(50-68)(51-70)(52-59)(52-66)(53-58)(53-64)(53-69)(54-68)(55-70)(56-57)(56-67)(57-66)(58-66)(58-67)(59-71)(60-73)(61-72)(62-74)(63-75)(64-76)(65-69)(65-76)(67-77)(68-77)(69-77)(70-77)(76-77)
Measurements (1)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| PC-3 | 4.5 | 1.9 | 10.1016/j.jinorgbio.2022.11179... | 2022 |
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.