home← all complexes Ir builderC^N familiesD-MPNN

Complex #5935 — Ir(3) [Ir9]

2D Structure

Structure
⬇ MOL V3000

Info

ID5935
MetalIr
Oxidation state3
Charge0
Donor atoms{"N": 2}
AbbreviationIr9
SMILESCc1c(C)c(C)[c-](C)c1C.Cc1ccc(-n2c(-c3[c-]cccc3)nc3c4ccccc4c4ccccc4c32)cc1.[Cl-]

TUCAN

C38ClIrN2/(1-24)(2-25)(3-26)(4-29)(5-31)(6-32)(7-8)(7-18)(8-27)(9-11)(9-33)(10-22)(10-37)(11-21)(12-17)(12-20)(13-23)(13-37)(14-17)(14-34)(15-16)(15-21)(16-33)(18-19)(19-30)(20-28)(22-29)(23-29)(24-25)(24-26)(25-31)(26-32)(27-30)(27-35)(28-34)(28-36)(30-34)(31-32)(33-38)(35-36)(35-39)(36-40)(37-40)(38-39)(38-40)

Measurements (2)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
A54966— 10.1016/j.jinorgbio.2024.11261... 2024
BEAS-2B70— 10.1016/j.jinorgbio.2024.11261... 2024

🧬 Cell Death Types (1)

Apoptosis high
«Western blotting further confirmed that complexes could induce A549 cell apoptosis through the lysosomal-mitochondrial anticancer pathway»

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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