Info
| ID | 5503 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 4} |
| Abbreviation | 1 |
| SMILES | Cc1c(C)c(C)[c-](-c2ccc(-c3ccccc3)cc2)c1C.Nc1ccnc(-c2cc(N)ccn2)c1.[Cl-] |
TUCAN
C31H31IrN4/(1-41)(2-46)(3-44)(4-32)(5-32)(6-47)(7-45)(8-43)(9-39)(10-32)(11-42)(12-36)(13-57)(14-37)(15-38)(16-48)(17-58)(18-40)(19-35)(20-33)(21-33)(22-33)(23-35)(24-35)(25-34)(26-34)(27-34)(28-63)(29-63)(30-64)(31-64)(32-49)(33-50)(34-51)(35-54)(36-57)(36-59)(37-59)(37-61)(38-60)(38-62)(39-46)(39-52)(40-47)(40-52)(41-44)(41-55)(42-44)(42-45)(43-45)(43-55)(46-56)(47-56)(48-58)(48-60)(49-50)(49-53)(50-51)(51-54)(52-53)(53-54)(55-56)(57-65)(58-66)(59-63)(60-64)(61-62)(61-65)(62-66)(65-67)(66-67)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A549 | 31 | — | 10.1039/c8nj03360a | 2018 |
| BEAS-2B | 70 | — | 10.1039/c8nj03360a | 2018 |
| 16HBE | 75 | — | 10.1039/c8nj03360a | 2018 |
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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