Info
| ID | 5220 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 0 |
| Donor atoms | {"N": 2} |
| Abbreviation | 6 |
| SMILES | Cc1c(C)c(C)[c-](C)c1C.O=C([N-]c1ccc(F)cc1F)c1ccccn1.[Cl-] |
TUCAN
C22H22F2IrN2O/(1-23)(2-23)(3-23)(4-24)(5-24)(6-24)(7-25)(8-25)(9-33)(10-28)(11-32)(12-31)(13-30)(14-39)(15-29)(16-25)(17-26)(18-26)(19-26)(20-27)(21-27)(22-27)(23-34)(24-35)(25-36)(26-37)(27-38)(28-33)(28-40)(29-43)(29-44)(30-32)(30-44)(31-33)(31-39)(32-41)(34-35)(34-36)(35-37)(36-38)(37-38)(39-45)(40-42)(40-45)(41-43)(41-46)(42-46)(42-47)(43-48)(44-49)(45-50)(46-50)
Measurements (1)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A2780 | 20 | — | 10.1021/ic401529u | 2014 |
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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