Info
| ID | 5540 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 5} |
| Abbreviation | 1d′ |
| SMILES | Cn1[c-][n+](C)c2ccccc21.Fc1c(F)c(F)c(-c2c3nc(c(-c4c(F)c(F)c(F)c(F)c4F)c4ccc([n-]4)c(-c4c(F)c(F)c(F)c(F)c4F)c4nc(c(-c5c(F)c(F)c(F)c(F)c5F)c5ccc2[n-]5)C=C4)C=C3)c(F)c1F.N |
TUCAN
C53H18F20IrN6/(1-21)(2-29)(3-20)(4-39)(5-39)(6-39)(7-40)(8-40)(9-19)(10-23)(11-22)(12-25)(13-27)(14-26)(15-28)(16-30)(17-24)(18-40)(19-23)(19-41)(20-21)(20-49)(21-29)(22-27)(22-45)(23-42)(24-25)(24-44)(25-47)(26-28)(26-46)(27-43)(28-48)(29-30)(30-50)(31-34)(31-54)(31-65)(32-36)(32-43)(32-48)(33-35)(33-41)(33-44)(34-42)(34-45)(35-62)(35-64)(36-52)(36-56)(37-38)(37-46)(37-47)(38-66)(38-67)(39-74)(40-75)(41-76)(42-76)(43-72)(44-77)(45-72)(46-73)(47-77)(48-73)(49-50)(49-74)(50-75)(51-74)(51-75)(52-59)(52-86)(53-55)(53-63)(53-78)(54-58)(54-85)(55-62)(55-83)(56-69)(56-94)(57-59)(57-69)(57-90)(58-70)(58-80)(59-79)(60-65)(60-70)(60-84)(61-66)(61-71)(61-88)(62-87)(63-64)(63-95)(64-97)(65-91)(66-92)(67-68)(67-93)(68-71)(68-89)(69-81)(70-82)(71-96)(76-98)(77-98)
Measurements (6)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | 0.37 | — | 10.1039/C8SC02920B | 2019 |
| HCT-116 | 0.42 | — | 10.1039/C8SC02920B | 2019 |
| NCI-H460 | 0.46 | 0.04 | 10.1039/C8SC02920B | 2019 |
| HCC827 | 0.55 | — | 10.1039/C8SC02920B | 2019 |
| MCF-7 | 0.71 | — | 10.1039/C8SC02920B | 2019 |
| HepG2 | 1.6 | — | 10.1039/C8SC02920B | 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.