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Complex #5682 — Ir(3) [ole-Ir]

2D Structure

Structure
⬇ MOL V3000

Info

ID5682
MetalIr
Oxidation state3
Charge1
Donor atoms{"N": 3}
Abbreviationole-Ir
SMILESCc1c(C)c(C)[c-](C)c1C.Cc1ccnc(-c2cc(CNC(=O)[C@]34CCC(C)(C)C[C@H]3C3=CC[C@@H]5[C@@]6(C)CC[C@H](O)C(C)(C)[C@@H]6CC[C@@]5(C)[C@]3(C)CC4)ccn2)c1.[Cl-]

TUCAN

C52H74IrN3O2/(1-122)(2-81)(3-121)(4-101)(5-122)(6-101)(7-90)(8-125)(9-91)(10-75)(11-75)(12-75)(13-76)(14-76)(15-76)(16-77)(17-77)(18-83)(19-102)(20-80)(21-85)(22-94)(23-82)(24-82)(25-99)(26-81)(27-82)(28-94)(29-100)(30-120)(31-85)(32-84)(33-89)(34-113)(35-98)(36-84)(37-81)(38-86)(39-80)(40-99)(41-86)(42-97)(43-98)(44-95)(45-102)(46-100)(47-88)(48-96)(49-80)(50-87)(51-86)(52-112)(53-111)(54-96)(55-93)(56-97)(57-93)(58-95)(59-84)(60-87)(61-85)(62-92)(63-87)(64-83)(65-77)(66-78)(67-78)(68-78)(69-79)(70-79)(71-79)(72-83)(73-127)(74-131)(75-103)(76-104)(77-105)(78-106)(79-107)(80-119)(81-114)(82-115)(83-108)(84-116)(85-117)(86-114)(87-119)(88-108)(88-124)(89-95)(89-110)(90-109)(90-123)(91-108)(91-121)(92-109)(92-120)(93-98)(93-119)(94-100)(94-118)(95-111)(96-97)(96-117)(97-113)(98-118)(99-112)(99-119)(100-115)(101-102)(101-125)(102-116)(103-104)(103-105)(104-106)(105-107)(106-107)(109-122)(110-112)(110-115)(111-116)(111-117)(112-118)(113-114)(113-116)(114-125)(115-117)(118-126)(120-128)(121-129)(122-127)(123-124)(123-128)(124-129)(125-131)(126-127)(126-130)(128-132)(129-132)(131-132)

Measurements (5)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
NB45.5 10.1016/j.jinorgbio.2025.11295... 2025
A27806.2 10.1016/j.jinorgbio.2025.11295... 2025
MCF-711 10.1016/j.jinorgbio.2025.11295... 2025
HLF15 10.1016/j.jinorgbio.2025.11295... 2025
A54917 10.1016/j.jinorgbio.2025.11295... 2025