home← all complexes Ir builderC^N familiesD-MPNN

Complex #1253 — Ru(2) [12]

2D Structure

Structure
⬇ MOL V3000

Info

ID1253
MetalRu
Oxidation state2
Charge0
Donor atoms{"P": 1, "O": 1}
Abbreviation12
SMILESCOc1ccccc1P(c1ccccc1OC)c1ccc2ccccc2c1S(=O)(=O)[O-].Cc1ccc(C(C)C)cc1.[Cl-]

TUCAN

C34H34O5PRuS/(1-35)(2-36)(3-35)(4-42)(5-62)(6-40)(7-50)(8-38)(9-44)(10-45)(11-43)(12-35)(13-36)(14-60)(15-55)(16-47)(17-51)(18-48)(19-41)(20-36)(21-39)(22-37)(23-37)(24-37)(25-61)(26-61)(27-61)(28-54)(29-62)(30-46)(31-52)(32-53)(33-49)(34-62)(35-56)(36-60)(37-60)(38-40)(38-56)(39-50)(39-56)(40-58)(41-43)(41-46)(42-44)(42-45)(43-57)(44-63)(45-48)(46-49)(47-55)(47-65)(48-66)(49-59)(50-58)(51-52)(51-67)(52-53)(53-54)(54-64)(55-59)(57-59)(57-68)(58-60)(61-73)(62-69)(63-66)(63-69)(64-67)(64-73)(65-68)(65-74)(66-74)(67-74)(68-75)(70-75)(71-75)(72-75)(73-76)(74-76)

Measurements (3)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
A54923— 10.1016/j.dyepig.2018.11.009 2018
HeLa24— 10.1016/j.dyepig.2018.11.009 2018
16HBE35— 10.1016/j.dyepig.2018.11.009 2018

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
Loading source metadata…
The generated SVG will appear here. The legacy ligand image above stays visible for side-by-side review.