home← all complexes Ir builderC^N familiesD-MPNN

Complex #5920 — Ir(3) [Ir2]

2D Structure

Structure
⬇ MOL V3000

Info

ID5920
MetalIr
Oxidation state3
Charge1
Donor atoms{"N": 6}
AbbreviationIr2
SMILESO=c1c(-c2nc3c4cccnc4c4ncccc4c3[nH]2)coc2ccccc12.[c-]1cccc2ccc3cccnc3c12.[c-]1cccc2ccc3cccnc3c12

TUCAN

C48H28IrN6O2/(1-31)(2-43)(3-34)(4-48)(5-36)(6-41)(7-50)(8-44)(9-63)(10-74)(11-64)(12-51)(13-65)(14-40)(15-46)(16-39)(17-47)(18-32)(19-35)(20-45)(21-66)(22-37)(23-52)(24-38)(25-49)(26-33)(27-42)(28-78)(29-41)(29-56)(30-49)(30-59)(31-34)(31-63)(32-36)(32-53)(33-44)(33-53)(34-54)(35-50)(35-55)(36-54)(37-40)(37-65)(38-39)(38-46)(39-58)(40-57)(41-44)(42-47)(42-55)(43-48)(43-64)(45-51)(45-62)(46-52)(47-49)(48-60)(50-60)(51-66)(52-75)(53-56)(54-67)(55-59)(56-67)(57-71)(57-72)(58-75)(58-76)(59-70)(60-70)(61-73)(61-74)(61-76)(62-68)(62-69)(63-79)(64-80)(65-77)(66-82)(67-79)(68-72)(68-81)(69-71)(69-82)(70-80)(71-77)(72-78)(73-78)(73-81)(74-84)(75-84)(76-83)(79-85)(80-85)(81-85)(82-85)(84-85)

Measurements (2)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HCT-1166.1— 10.3390/molecules27175434 2022
LO241— 10.3390/molecules27175434 2022

🧬 Cell Death Types (4)

Apoptosis high
«the results show that the complexes can effectively induce apoptosis.»
Autophagy high
«The results show that the complexes can effectively induce autophagy.»
Ferroptosis high
«the results show that the complexes can trigger oxidant stress and further induce ferroptosis.»
Immunogenic Cell Death high
«Hence, the complexes can induce immunogenic cell death.»

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.

experimental validation surface
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