Info
| ID | 2328 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 5, "P": 1} |
| Abbreviation | 5 BF4 |
| SMILES | C1N2CN3CN1CP(C2)C3.Cc1ccc(C(C)C)cc1.Cn1cncc1-c1cn(CCCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)nn1.[Cl-] |
TUCAN
C34H40F17N8PRu/(1-49)(2-43)(3-43)(4-44)(5-43)(6-53)(7-45)(8-41)(9-41)(10-41)(11-47)(12-42)(13-42)(14-46)(15-42)(16-61)(17-61)(18-72)(19-62)(20-54)(21-54)(22-60)(23-54)(24-56)(25-55)(26-57)(27-57)(28-50)(29-50)(30-49)(31-48)(32-48)(33-72)(34-73)(35-73)(36-62)(37-63)(38-63)(39-74)(40-74)(41-53)(42-53)(43-51)(44-45)(44-51)(45-52)(46-47)(46-51)(47-52)(48-49)(48-50)(49-68)(50-57)(52-53)(54-78)(55-58)(55-81)(56-59)(56-80)(57-80)(58-59)(58-78)(59-79)(60-78)(60-81)(61-75)(61-77)(62-75)(62-76)(63-76)(63-77)(64-68)(64-69)(64-90)(64-93)(65-67)(65-71)(65-89)(65-99)(66-67)(66-70)(66-87)(66-88)(67-84)(67-86)(68-83)(68-85)(69-70)(69-94)(69-95)(70-96)(70-97)(71-91)(71-92)(71-98)(72-75)(72-100)(73-76)(73-100)(74-77)(74-100)(79-82)(80-82)(81-101)(82-101)(100-101)
Measurements (2)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A2780cisR | 34 | — | 10.1016/j.jorganchem.2010.09.0... | 2011 |
| A2780 | 55 | — | 10.1016/j.jorganchem.2010.09.0... | 2011 |
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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