Info
| ID | 5532 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 0 |
| Donor atoms | {"N": 8} |
| Abbreviation | 2 |
| SMILES | CC1=CC(C)=[N+]2C1=C(c1ccc(N=C=[N-])cc1)c1c(C)cc(C)n1[B-]2(F)F.COc1cc(-c2nc3ccccc3n2C)[c-]c(-c2nc3ccccc3n2C)c1.[c-]1ccccc1-c1nccc2ccccc12 |
TUCAN
C58H47BF2IrN9O/(1-89)(2-57)(3-60)(4-72)(5-75)(6-91)(7-89)(8-105)(9-61)(10-59)(11-66)(12-63)(13-64)(14-51)(15-49)(16-65)(17-74)(18-76)(19-67)(20-105)(21-70)(22-89)(23-73)(24-58)(25-105)(26-55)(27-90)(28-56)(29-49)(30-62)(31-49)(32-51)(33-50)(34-71)(35-51)(36-50)(37-52)(38-52)(39-52)(40-79)(41-78)(42-90)(43-68)(44-90)(45-77)(46-69)(47-50)(48-108)(48-109)(48-117)(48-118)(49-93)(50-101)(51-83)(52-88)(53-60)(53-81)(54-80)(54-87)(55-60)(55-70)(56-72)(56-92)(57-80)(57-106)(58-86)(58-91)(59-66)(59-82)(61-87)(61-106)(62-63)(62-94)(63-84)(64-83)(64-93)(65-66)(65-67)(67-86)(68-70)(68-81)(69-74)(69-98)(71-88)(71-101)(72-73)(73-75)(74-77)(75-96)(76-77)(76-99)(78-79)(78-94)(79-84)(80-103)(81-100)(82-86)(82-100)(83-95)(84-85)(85-95)(85-97)(87-104)(88-97)(89-110)(90-111)(91-113)(92-96)(92-112)(93-108)(94-115)(95-108)(96-110)(97-109)(98-99)(98-114)(99-111)(100-113)(101-109)(102-107)(102-115)(103-110)(103-112)(104-111)(104-114)(105-116)(106-116)(112-119)(113-119)(114-119)(115-119)(116-119)
Measurements (1)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | 60 | 0.53 | 10.1039/C7RA05579J | 2017 |
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.