Info
| ID | 6988 |
| Metal | Rh |
| Oxidation state | 3 |
| Charge | 0 |
| Donor atoms | {"S": 2, "O": 2, "N": 2} |
| Abbreviation | A2 |
| SMILES | CS(C)=O.CS(C)=O.[Cl-].[Cl-].[Cl-].c1ccc2[nH]ncc2c1 |
TUCAN
C11H18N2O2RhS2/(1-19)(2-26)(3-26)(4-26)(5-24)(6-21)(7-27)(8-27)(9-27)(10-28)(11-28)(12-28)(13-29)(14-22)(15-20)(16-29)(17-29)(18-30)(19-22)(19-23)(20-21)(20-22)(21-25)(23-24)(23-25)(24-31)(25-30)(26-34)(27-34)(28-35)(29-35)(30-31)(31-36)(32-34)(33-35)(34-36)(35-36)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A2780 | 0.1 | — | 10.1021/acs.inorgchem.8b03477 | 2019 |
| A2780cisR | 0.22 | — | 10.1021/acs.inorgchem.8b03477 | 2019 |
| MDA-MB-231 | 0.62 | — | 10.1021/acs.inorgchem.8b03477 | 2019 |
| A549 | 5.2 | — | 10.1021/acs.inorgchem.8b03477 | 2019 |
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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