Info
| ID | 5180 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 3, "P": 1} |
| Abbreviation | Ir3 |
| SMILES | C(=N/CCc1ccccc1)\c1ccccc1P(c1ccccc1)c1ccccc1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1 |
TUCAN
C49H40IrN3P/(1-48)(2-52)(3-55)(4-65)(5-49)(6-50)(7-81)(8-45)(9-57)(10-82)(11-44)(12-43)(13-61)(14-47)(15-53)(16-56)(17-59)(18-71)(19-76)(20-76)(21-84)(22-84)(23-83)(24-66)(25-64)(26-73)(27-75)(28-69)(29-70)(30-51)(31-46)(32-54)(33-74)(34-60)(35-67)(36-72)(37-68)(38-62)(39-63)(40-58)(41-49)(41-77)(42-69)(42-79)(43-47)(43-81)(44-45)(44-49)(45-50)(46-63)(46-82)(47-48)(48-85)(50-77)(51-62)(51-68)(52-55)(52-65)(53-54)(53-59)(54-58)(55-57)(56-74)(56-80)(57-87)(58-71)(59-78)(60-66)(60-89)(61-65)(61-87)(62-69)(63-70)(64-67)(64-88)(66-74)(67-73)(68-79)(70-86)(71-78)(72-73)(72-75)(75-88)(76-78)(76-84)(77-85)(79-86)(80-83)(80-89)(81-90)(82-92)(83-91)(84-91)(85-90)(86-92)(87-93)(88-93)(89-93)(90-94)(91-94)(92-94)(93-94)
Measurements (7)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HCT-116 | 2.2 | — | 10.1039/c9qi01492f | 2020 |
| 4T1 | 2.4 | — | 10.1039/c9qi01492f | 2020 |
| CT-26 | 2.5 | — | 10.1039/c9qi01492f | 2020 |
| HepG2 | 2.7 | — | 10.1039/c9qi01492f | 2020 |
| A549 | 2.9 | — | 10.1039/c9qi01492f | 2020 |
| HT-29 | 3.1 | — | 10.1039/c9qi01492f | 2020 |
| HeLa | 3.3 | — | 10.1039/c9qi01492f | 2020 |
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.