Info
| ID | 1899 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 0 |
| Donor atoms | {"N": 3, "S": 1, "O": 1, "P": 1} |
| Abbreviation | 1 |
| SMILES | N/C([S-])=N/N=C1/C(=O)c2ccccc2-c2ccccc21.[C-]#[O+].[Cl-].c1ccc(P(c2ccccc2)c2ccccc2)cc1 |
TUCAN
C34H25N3O2PRuS/(1-28)(2-29)(3-26)(4-31)(5-27)(6-32)(7-30)(8-37)(9-40)(10-46)(11-47)(12-48)(13-44)(14-38)(15-35)(16-33)(17-36)(18-41)(19-42)(20-34)(21-39)(22-43)(23-45)(24-60)(25-60)(26-28)(26-31)(27-29)(27-31)(28-56)(29-56)(30-32)(30-57)(32-40)(33-34)(33-47)(34-49)(35-37)(35-40)(36-38)(36-42)(37-57)(38-58)(39-41)(39-42)(41-58)(43-48)(43-50)(44-45)(44-48)(45-52)(46-47)(46-51)(49-50)(49-51)(50-52)(51-53)(52-55)(53-55)(53-61)(54-63)(55-64)(56-65)(57-65)(58-65)(59-60)(59-62)(59-66)(61-62)(61-67)(62-67)(65-67)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MCF-7 | 9.3 | — | 10.1016/j.jphotobiol.2013.09.0... | 2013 |
| MDA-MB-468 | 13 | — | 10.1016/j.jphotobiol.2013.09.0... | 2013 |
| A431 | 23 | — | 10.1016/j.jphotobiol.2013.09.0... | 2013 |
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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