home← all complexes Ir builderC^N familiesD-MPNN

Complex #5710 — Ir(3) [Ir-OH]

2D Structure

Structure
⬇ MOL V3000

Info

ID5710
MetalIr
Oxidation state3
Charge1
Donor atoms{"N": 4}
AbbreviationIr-OH
SMILESCc1ccnc(-c2cc(CO)ccn2)c1.[c-]1ccccc1-c1ccc2ccccc2n1.[c-]1ccccc1-c1ccc2ccccc2n1

TUCAN

C42H32IrN4O/(1-36)(2-48)(3-41)(4-39)(5-45)(6-38)(7-47)(8-50)(9-67)(10-52)(11-58)(12-66)(13-43)(14-37)(15-53)(16-42)(17-57)(18-55)(19-59)(20-40)(21-33)(22-74)(23-49)(24-54)(25-56)(26-44)(27-51)(28-46)(29-33)(30-33)(31-74)(32-79)(33-62)(34-44)(34-60)(35-51)(35-61)(36-37)(36-38)(37-50)(38-71)(39-41)(39-60)(40-62)(40-67)(41-42)(42-44)(43-49)(43-61)(45-48)(45-68)(46-54)(46-55)(47-55)(47-72)(48-63)(49-57)(50-63)(51-57)(52-62)(52-73)(53-56)(53-65)(54-65)(56-70)(58-64)(58-69)(59-64)(59-66)(60-68)(61-70)(63-71)(64-74)(65-72)(66-78)(67-77)(68-75)(69-73)(69-78)(70-76)(71-75)(72-76)(73-77)(74-79)(75-80)(76-80)(77-80)(78-80)

Measurements (3)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa1.90.049 10.1007/s00775-022-01957-0 2022
MCF-73.50.085 10.1007/s00775-022-01957-0 2022
143B5.20.093 10.1007/s00775-022-01957-0 2022

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
Loading source metadata…
The generated SVG will appear here. The legacy ligand image above stays visible for side-by-side review.