Info
| ID | 5513 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 7} |
| Abbreviation | 1 |
| SMILES | O=c1[nH]c2ccccc2cc1-c1nc2c3cccnc3c3ncccc3c2[nH]1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1 |
TUCAN
C44H29IrN7O/(1-61)(2-39)(3-44)(4-63)(5-32)(6-34)(7-36)(8-38)(9-48)(10-46)(11-62)(12-47)(13-33)(14-50)(15-41)(16-43)(17-64)(18-40)(19-49)(20-52)(21-53)(22-42)(23-51)(24-45)(25-37)(26-54)(27-35)(28-76)(29-75)(30-46)(30-55)(31-49)(31-56)(32-39)(32-55)(33-39)(33-46)(34-38)(34-61)(35-40)(35-56)(36-48)(36-62)(37-40)(37-49)(38-47)(41-42)(41-60)(42-50)(43-45)(43-57)(44-54)(44-63)(45-64)(47-65)(48-52)(50-53)(51-59)(51-60)(52-71)(53-70)(54-58)(55-65)(56-71)(57-67)(57-69)(58-66)(58-68)(59-72)(59-73)(60-70)(61-77)(62-80)(63-74)(64-79)(65-77)(66-67)(66-74)(67-79)(68-69)(68-75)(69-78)(70-76)(71-80)(72-75)(72-78)(73-76)(73-81)(77-82)(78-82)(79-82)(80-82)
Measurements (1)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | 60 | — | 10.1039/C8NJ03390K | 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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The generated SVG will appear here. The legacy ligand image above stays visible for side-by-side review.