Info
| ID | 5438 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 3} |
| Abbreviation | Ir9 |
| SMILES | CC(C)c1ccc(-n2[c-]c(-c3ccccn3)[n+](C)n2)c(C(C)C)c1.Cc1c(C)c(C)[c-](C)c1C.[Cl-] |
TUCAN
C30H39IrN4/(1-43)(2-40)(3-43)(4-40)(5-40)(6-41)(7-41)(8-41)(9-42)(10-42)(11-42)(12-45)(13-45)(14-45)(15-46)(16-46)(17-49)(18-43)(19-52)(20-47)(21-54)(22-53)(23-63)(24-47)(25-64)(26-64)(27-66)(28-50)(29-51)(30-47)(31-48)(32-48)(33-48)(34-44)(35-46)(36-62)(37-44)(38-44)(39-64)(40-55)(41-56)(42-57)(43-62)(44-62)(45-59)(46-60)(47-63)(48-63)(49-58)(49-61)(50-51)(50-66)(51-52)(52-67)(53-54)(53-69)(54-61)(55-56)(55-57)(56-59)(57-60)(58-62)(58-69)(59-60)(61-63)(64-70)(65-68)(65-71)(66-72)(67-68)(67-72)(68-70)(69-71)(70-73)(71-73)(72-74)(73-74)
Measurements (5)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | 2 | — | 10.1021/acs.organomet.9b00327 | 2019 |
| HCT-116 | 3 | — | 10.1021/acs.organomet.9b00327 | 2019 |
| NCI-H460 | 3.2 | — | 10.1021/acs.organomet.9b00327 | 2019 |
| MES-OV | 4.1 | — | 10.1021/acs.organomet.9b00327 | 2019 |
| HEp-2 | 4.7 | — | 10.1021/acs.organomet.9b00327 | 2019 |
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.