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D-MPNN
Complex #5802 — Ir(3)
[Ir-N,N Py,Ph]
2D Structure
⬇ MOL V3000
Info
ID
5802
Metal
Ir
Oxidation state
3
Charge
1
Donor atoms
{"N": 5}
Abbreviation
Ir-N,N Py,Ph
SMILES
Cc1c(C)c(C)[c-](C)c1C.[Cl-].c1ccc(-c2nnc(-c3ccccn3)nn2)cc1
TUCAN
C23H24IrN5/(1-25)(2-25)(3-25)(4-26)(5-26)(6-26)(7-30)(8-32)(9-33)(10-34)(11-35)(12-31)(13-37)(14-44)(15-36)(16-27)(17-27)(18-27)(19-28)(20-28)(21-28)(22-29)(23-29)(24-29)(25-39)(26-40)(27-41)(28-42)(29-43)(30-33)(30-38)(31-33)(31-35)(32-35)(32-38)(34-37)(34-45)(36-37)(36-44)(38-46)(39-40)(39-41)(40-42)(41-43)(42-43)(44-48)(45-47)(45-48)(46-49)(46-52)(47-50)(47-51)(49-50)(51-52)(51-53)(52-53)
Measurements (1)
Cell line
IC₅₀ dark (µM)
IC₅₀ light (µM)
DOI
Year
HeLa
—
—
10.1002/cbic.202500090
2025