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D-MPNN
Complex #5219 — Ir(3)
[5]
2D Structure
⬇ MOL V3000
Info
ID
5219
Metal
Ir
Oxidation state
3
Charge
0
Donor atoms
{"N": 2}
Abbreviation
5
SMILES
Cc1c(C)c(C)[c-](C)c1C.O=C([N-]c1cc(Cl)ccc1Cl)c1ccccn1.[Cl-]
TUCAN
C22H22Cl2IrN2O/(1-23)(2-23)(3-23)(4-24)(5-24)(6-24)(7-25)(8-25)(9-33)(10-28)(11-32)(12-31)(13-30)(14-39)(15-29)(16-25)(17-26)(18-26)(19-26)(20-27)(21-27)(22-27)(23-34)(24-35)(25-36)(26-37)(27-38)(28-33)(28-40)(29-30)(29-43)(30-44)(31-33)(31-39)(32-41)(32-44)(34-35)(34-36)(35-37)(36-38)(37-38)(39-45)(40-42)(40-45)(41-43)(41-46)(42-46)(42-47)(43-48)(44-49)(45-50)(46-50)
Measurements (1)
Cell line
IC₅₀ dark (µM)
IC₅₀ light (µM)
DOI
Year
A2780
23
—
10.1021/ic401529u
2014