Info
| ID | 3132 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 2} |
| Abbreviation | [Ru(η6-p-cymene)(bpen)Cl]+ 2 |
| SMILES | C(Cc1cc2ccc3cccc4ccc(c1)c2c34)=NCCN=Cc1cc2ccc3cccc4ccc(c1)c2c34.Cc1ccc(C(C)C)cc1.[Cl-] |
TUCAN
C47H40N2Ru/(1-42)(2-52)(3-53)(4-87)(5-59)(6-51)(7-56)(8-87)(9-84)(10-49)(11-44)(12-41)(13-45)(14-42)(15-42)(16-47)(17-43)(18-43)(19-55)(20-41)(21-61)(22-86)(23-57)(24-63)(25-64)(26-86)(27-48)(28-60)(29-46)(30-41)(31-85)(32-66)(33-50)(34-54)(35-83)(36-43)(37-65)(38-66)(39-58)(40-62)(41-77)(42-83)(43-83)(44-45)(44-77)(45-67)(46-47)(46-67)(47-77)(48-52)(48-74)(49-54)(49-68)(50-56)(50-62)(51-59)(51-70)(52-68)(53-74)(53-76)(54-58)(55-76)(55-81)(56-79)(57-70)(57-78)(58-69)(59-79)(60-61)(60-81)(61-69)(62-82)(63-64)(63-82)(64-80)(65-78)(65-80)(66-78)(66-85)(67-83)(68-73)(69-73)(70-75)(71-75)(71-79)(71-82)(72-73)(72-74)(72-81)(75-80)(76-84)(84-89)(85-88)(86-87)(86-89)(87-88)(88-90)(89-90)
Measurements (2)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MCF-7 | — | — | 10.1002/aoc.4756 | 2018 |
| HepG2 | — | — | 10.1002/aoc.4756 | 2018 |
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.
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