Info
| ID | 5350 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 4} |
| Abbreviation | Ir3 |
| SMILES | CCCCn1[c-][n+](/C(C)=N/c2c(C)cccc2C)cc1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1 |
TUCAN
C39H39IrN5/(1-42)(2-70)(3-53)(4-47)(5-52)(6-51)(7-72)(8-71)(9-49)(10-69)(11-50)(12-42)(13-41)(14-41)(15-42)(16-41)(17-43)(18-55)(19-40)(20-40)(21-43)(22-43)(23-59)(24-46)(25-61)(26-60)(27-64)(28-73)(29-40)(30-63)(31-62)(32-57)(33-48)(34-58)(35-54)(36-64)(37-73)(38-63)(39-56)(40-64)(41-78)(42-66)(43-68)(44-49)(44-65)(45-50)(45-67)(46-48)(46-70)(47-49)(47-51)(48-52)(50-57)(51-53)(52-74)(53-65)(54-60)(54-61)(55-62)(55-66)(56-62)(56-68)(57-59)(58-59)(58-67)(60-71)(61-76)(63-64)(63-73)(65-74)(66-75)(67-76)(68-75)(69-72)(69-79)(70-81)(71-83)(72-80)(73-80)(74-81)(75-82)(76-83)(77-79)(77-80)(78-79)(78-82)(81-84)(82-84)(83-84)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A549 | 2.6 | — | 10.1016/j.dyepig.2018.09.044 | 2019 |
| 16HBE | 2.7 | — | 10.1016/j.dyepig.2018.09.044 | 2019 |
| BEAS-2B | 3.5 | — | 10.1016/j.dyepig.2018.09.044 | 2019 |
| HeLa | 3.8 | — | 10.1016/j.dyepig.2018.09.044 | 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.
Loading source metadata…
The generated SVG will appear here. The legacy ligand image above stays visible for side-by-side review.