home← all complexes D-MPNN

Complex #5540 — Ir(3) [1d′]

2D Structure

Structure
⬇ MOL V3000

Info

ID5540
MetalIr
Oxidation state3
Charge1
Donor atoms{"N": 5}
Abbreviation1d′
SMILESCn1[c-][n+](C)c2ccccc21.Fc1c(F)c(F)c(-c2c3nc(c(-c4c(F)c(F)c(F)c(F)c4F)c4ccc([n-]4)c(-c4c(F)c(F)c(F)c(F)c4F)c4nc(c(-c5c(F)c(F)c(F)c(F)c5F)c5ccc2[n-]5)C=C4)C=C3)c(F)c1F.N

TUCAN

C53H18F20IrN6/(1-21)(2-29)(3-20)(4-39)(5-39)(6-39)(7-40)(8-40)(9-19)(10-23)(11-22)(12-25)(13-27)(14-26)(15-28)(16-30)(17-24)(18-40)(19-23)(19-41)(20-21)(20-49)(21-29)(22-27)(22-45)(23-42)(24-25)(24-44)(25-47)(26-28)(26-46)(27-43)(28-48)(29-30)(30-50)(31-34)(31-54)(31-65)(32-36)(32-43)(32-48)(33-35)(33-41)(33-44)(34-42)(34-45)(35-62)(35-64)(36-52)(36-56)(37-38)(37-46)(37-47)(38-66)(38-67)(39-74)(40-75)(41-76)(42-76)(43-72)(44-77)(45-72)(46-73)(47-77)(48-73)(49-50)(49-74)(50-75)(51-74)(51-75)(52-59)(52-86)(53-55)(53-63)(53-78)(54-58)(54-85)(55-62)(55-83)(56-69)(56-94)(57-59)(57-69)(57-90)(58-70)(58-80)(59-79)(60-65)(60-70)(60-84)(61-66)(61-71)(61-88)(62-87)(63-64)(63-95)(64-97)(65-91)(66-92)(67-68)(67-93)(68-71)(68-89)(69-81)(70-82)(71-96)(76-98)(77-98)

Measurements (6)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa0.37 10.1039/C8SC02920B 2019
HCT-1160.42 10.1039/C8SC02920B 2019
NCI-H4600.460.04 10.1039/C8SC02920B 2019
HCC8270.55 10.1039/C8SC02920B 2019
MCF-70.71 10.1039/C8SC02920B 2019
HepG21.6 10.1039/C8SC02920B 2019