Info
| ID | 5327 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 4} |
| Abbreviation | 2 |
| SMILES | COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccnc(-c4cc(-c5ccc(N(c6ccc(OC)cc6)c6ccc(OC)cc6)cc5)ccn4)c3)cc2)cc1.Cc1c(C)c(C)[c-](-c2ccccc2)c1C.[Cl-] |
TUCAN
C65H59IrN4O4/(1-61)(2-60)(3-60)(4-75)(5-84)(6-65)(7-71)(8-79)(9-60)(10-62)(11-61)(12-81)(13-85)(14-88)(15-74)(16-73)(17-69)(18-108)(19-67)(20-61)(21-117)(22-70)(23-86)(24-90)(25-82)(26-64)(27-117)(28-80)(29-62)(30-62)(31-63)(32-89)(33-72)(34-117)(35-77)(36-63)(37-66)(38-63)(39-118)(40-118)(41-87)(42-91)(43-76)(44-68)(45-118)(46-93)(47-83)(48-78)(49-107)(50-119)(51-119)(52-119)(53-95)(54-120)(55-120)(56-92)(57-96)(58-120)(59-94)(60-97)(61-104)(62-106)(63-105)(64-65)(64-98)(65-68)(66-67)(66-98)(67-68)(69-70)(69-123)(70-114)(71-84)(71-121)(72-85)(72-121)(73-74)(73-116)(74-101)(75-103)(75-113)(76-103)(76-108)(77-88)(77-122)(78-89)(78-122)(79-100)(79-107)(80-81)(80-111)(81-102)(82-83)(82-102)(83-111)(84-109)(85-109)(86-93)(86-101)(87-100)(87-110)(88-112)(89-112)(90-91)(90-114)(91-123)(92-95)(92-115)(93-116)(94-96)(94-115)(95-124)(96-124)(97-99)(97-104)(98-99)(99-106)(100-102)(101-103)(104-105)(105-106)(107-128)(108-127)(109-125)(110-113)(110-128)(111-125)(112-125)(113-127)(114-126)(115-126)(116-126)(117-129)(118-130)(119-131)(120-132)(121-129)(122-130)(123-131)(124-132)(127-133)(128-133)(131-133)(132-133)
Measurements (1)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A549 | — | — | 10.1016/j.dyepig.2018.08.006 | 2019 |
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.