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Complex #201 — Ru(3) [4]

2D Structure

Structure
⬇ MOL V3000

Info

ID201
MetalRu
Oxidation state3
Charge0
Donor atoms{"O": 2, "N": 2, "P": 1}
Abbreviation4
SMILES[Cl-].[O-]c1ccccc1-c1nc2ccccc2s1.[O-]c1ccccc1-c1nc2ccccc2s1.c1ccc(P(c2ccccc2)c2ccccc2)cc1

TUCAN

C44H31N2O2PRuS2/(1-33)(2-41)(3-35)(4-34)(5-36)(6-42)(7-37)(8-45)(9-38)(10-40)(11-55)(12-51)(13-39)(14-43)(15-58)(16-50)(17-44)(18-32)(19-47)(20-48)(21-59)(22-46)(23-53)(24-54)(25-49)(26-56)(27-52)(28-61)(29-57)(30-60)(31-62)(32-40)(32-58)(33-35)(33-41)(34-41)(34-43)(35-69)(36-45)(36-72)(37-42)(37-44)(38-47)(38-48)(39-42)(39-46)(40-65)(43-69)(44-70)(45-59)(46-70)(47-55)(48-63)(49-56)(49-64)(50-51)(50-53)(51-52)(52-54)(53-71)(54-71)(55-67)(56-61)(57-61)(57-68)(58-62)(59-60)(60-66)(62-73)(63-67)(63-74)(64-68)(64-75)(65-73)(65-76)(66-72)(66-77)(67-78)(68-79)(69-80)(70-80)(71-80)(72-81)(73-82)(74-77)(74-81)(75-76)(75-82)(76-83)(77-83)(80-83)(81-83)(82-83)

Measurements (2)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa26 10.1080/07391102.2020.1775126 2021
HCC7039 10.1080/07391102.2020.1775126 2021

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.

experimental validation surface
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