Info
| ID | 5543 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 6} |
| Abbreviation | 2e |
| SMILES | CC(C)n1[c-][n+](C(C)C)cc1.CC(C)n1[c-][n+](C(C)C)cc1.CCC1=C(CC)c2cc3[n-]c(cc4nc(cc5[n-]c(cc1n2)c(CC)c5CC)C(CC)=C4CC)c(CC)c3CC |
TUCAN
C54H76IrN8/(1-77)(2-79)(3-97)(4-100)(5-77)(6-101)(7-86)(8-80)(9-80)(10-125)(11-80)(12-81)(13-81)(14-126)(15-81)(16-82)(17-82)(18-77)(19-100)(20-97)(21-78)(22-98)(23-85)(24-101)(25-113)(26-114)(27-82)(28-99)(29-96)(30-93)(31-104)(32-102)(33-85)(34-79)(35-79)(36-98)(37-85)(38-84)(39-84)(40-84)(41-102)(42-78)(43-86)(44-86)(45-78)(46-94)(47-87)(48-95)(49-99)(50-103)(51-104)(52-87)(53-88)(54-87)(55-88)(56-103)(57-88)(58-83)(59-83)(60-83)(61-89)(62-89)(63-115)(64-116)(65-127)(66-89)(67-90)(68-90)(69-90)(70-128)(71-91)(72-91)(73-91)(74-92)(75-92)(76-92)(77-97)(78-98)(79-100)(80-125)(81-125)(82-126)(83-126)(84-102)(85-99)(86-101)(87-103)(88-104)(89-127)(90-127)(91-128)(92-128)(93-117)(93-119)(94-118)(94-120)(95-121)(95-124)(96-122)(96-123)(97-106)(98-107)(99-109)(100-105)(101-108)(102-110)(103-112)(104-111)(105-106)(105-120)(106-122)(107-110)(107-123)(108-109)(108-118)(109-117)(110-124)(111-112)(111-121)(112-119)(113-114)(113-133)(114-134)(115-116)(115-135)(116-136)(117-131)(118-131)(119-132)(120-137)(121-132)(122-137)(123-138)(124-138)(125-133)(126-134)(127-135)(128-136)(129-133)(129-134)(130-135)(130-136)(137-139)(138-139)
Measurements (6)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | 0.1 | — | 10.1039/C8SC02920B | 2019 |
| HCT-116 | 0.11 | — | 10.1039/C8SC02920B | 2019 |
| NCI-H460 | 0.16 | 0.006 | 10.1039/C8SC02920B | 2019 |
| HCC827 | 0.69 | — | 10.1039/C8SC02920B | 2019 |
| MCF-7 | 0.73 | — | 10.1039/C8SC02920B | 2019 |
| HepG2 | 2.4 | — | 10.1039/C8SC02920B | 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.