Info
| ID | 5705 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 6} |
| Abbreviation | PC9 |
| SMILES | Cn1ccnc1-c1nccn1C.Fc1c[c-]c(-c2ccc(C(F)(F)F)cn2)c(F)c1.Fc1c[c-]c(-c2ccc(C(F)(F)F)cn2)c(F)c1 |
TUCAN
C32H20F10IrN6/(1-25)(2-26)(3-24)(4-35)(5-35)(6-38)(7-35)(8-42)(9-36)(10-36)(11-37)(12-29)(13-41)(14-23)(15-39)(16-36)(17-27)(18-30)(19-28)(20-40)(21-24)(21-32)(22-28)(22-33)(23-25)(23-31)(24-48)(25-43)(26-47)(26-48)(27-30)(27-34)(28-49)(29-49)(29-50)(30-44)(31-37)(31-51)(32-43)(32-47)(33-44)(33-50)(34-41)(34-52)(35-53)(36-54)(37-55)(38-39)(38-53)(39-57)(40-42)(40-58)(41-56)(42-54)(43-55)(44-56)(45-46)(45-53)(45-57)(46-54)(46-58)(47-65)(48-60)(49-66)(50-68)(51-59)(51-61)(51-62)(52-63)(52-64)(52-67)(55-69)(56-69)(57-69)(58-69)
Measurements (2)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | 14 | 1.7 | 10.1016/j.freeradbiomed.2022.1... | 2022 |
| HepG2 | 14 | 4.4 | 10.1016/j.freeradbiomed.2022.1... | 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.