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D-MPNN
Complex #5401 — Ir(3)
[6]
2D Structure
⬇ MOL V3000
Info
ID
5401
Metal
Ir
Oxidation state
3
Charge
1
Donor atoms
{"N": 2}
Abbreviation
6
SMILES
C/C(=N\O)c1ccccn1.Cc1c(C)c(C)[c-](-c2ccc(-c3ccccc3)cc2)c1C.[Cl-]
TUCAN
C28H29IrN2O/(1-36)(2-31)(3-31)(4-37)(5-31)(6-30)(7-38)(8-34)(9-44)(10-32)(11-41)(12-42)(13-35)(14-39)(15-40)(16-30)(17-30)(18-34)(19-34)(20-33)(21-33)(22-33)(23-43)(24-55)(25-46)(26-45)(27-32)(28-32)(29-60)(30-53)(31-47)(32-57)(33-54)(34-52)(35-38)(35-43)(36-37)(36-49)(37-48)(38-50)(39-41)(39-43)(40-42)(40-49)(41-50)(42-48)(44-46)(44-56)(45-46)(45-55)(47-51)(47-53)(48-50)(49-51)(51-52)(52-54)(53-54)(55-58)(56-57)(56-58)(57-59)(58-61)(59-60)(59-61)
Measurements (1)
Cell line
IC₅₀ dark (µM)
IC₅₀ light (µM)
DOI
Year
A549
12
—
10.1007/s00775-018-1578-0
2018