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Complex #237 — Ru(2) [[(η6-p-cym)Ru(tmtp)Cl2] (1)]

2D Structure

Structure
⬇ MOL V3000

Info

ID237
MetalRu
Oxidation state2
Charge0
Donor atoms{"N": 4}
Abbreviation[(η6-p-cym)Ru(tmtp)Cl2] (1)
SMILESCc1ccc(C(C)C)cc1.Cc1nc2ncnn2c(C)c1C.[Cl-].[Cl-]

TUCAN

C18H24N4Ru/(1-25)(2-29)(3-29)(4-33)(5-28)(6-28)(7-29)(8-30)(9-41)(10-27)(11-26)(12-27)(13-26)(14-26)(15-27)(16-25)(17-25)(18-30)(19-30)(20-38)(21-31)(22-34)(23-32)(24-28)(25-40)(26-39)(27-35)(28-36)(29-38)(30-38)(31-33)(31-36)(32-34)(32-36)(33-37)(34-37)(35-39)(35-40)(37-38)(39-44)(40-45)(41-43)(41-46)(42-44)(42-45)(42-46)(43-44)(45-47)(46-47)

Measurements (3)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa3e+02 10.1039/d0dt03974h 2021
MCF-77.2e+02 10.1039/d0dt03974h 2021
L-929 10.1039/d0dt03974h 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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