Info
| ID | 6066 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 6} |
| Abbreviation | 2a-Cl |
| SMILES | CCCCNC(=O)c1ccnc(-c2cc(C(=O)NCCCC)ccn2)c1.Fc1c[c-]c(-c2ccccn2)c(F)c1.Fc1c[c-]c(-c2ccccn2)c(F)c1 |
TUCAN
C42H38F4IrN6O2/(1-45)(2-48)(3-39)(4-54)(5-67)(6-46)(7-43)(8-50)(9-39)(10-55)(11-53)(12-39)(13-40)(14-69)(15-68)(16-58)(17-49)(18-69)(19-58)(20-57)(21-47)(22-70)(23-44)(24-56)(25-60)(26-57)(27-51)(28-59)(29-52)(30-70)(31-65)(32-40)(33-60)(34-59)(35-66)(36-40)(37-81)(38-82)(39-57)(40-59)(41-46)(41-61)(42-55)(42-64)(43-45)(43-48)(44-77)(44-79)(45-65)(46-77)(47-52)(47-66)(48-71)(49-62)(49-67)(50-62)(50-72)(51-78)(51-80)(52-54)(53-63)(53-74)(54-73)(55-78)(56-63)(56-68)(57-58)(58-69)(59-60)(60-70)(61-71)(61-79)(62-75)(63-76)(64-73)(64-80)(65-85)(66-86)(67-83)(68-84)(69-81)(70-82)(71-85)(72-74)(72-83)(73-86)(74-84)(75-81)(75-87)(76-82)(76-88)(77-89)(78-91)(79-90)(80-92)(83-93)(84-93)(85-93)(86-93)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A549 | 3.7 | — | 10.1039/d3dt00028a | 2023 |
| HeLa | 5.5 | — | 10.1039/d3dt00028a | 2023 |
| BEAS-2B | 12 | — | 10.1039/d3dt00028a | 2023 |
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.