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Complex #1250 — Ru(2) [9]

2D Structure

Structure
⬇ MOL V3000

Info

ID1250
MetalRu
Oxidation state2
Charge0
Donor atoms{"O": 1, "P": 1}
Abbreviation9
SMILESCc1ccc(C(C)C)cc1.O=S(=O)([O-])c1ccccc1P(c1ccccc1)c1ccccc1.[Cl-]

TUCAN

C28H28O3PRuS/(1-47)(2-44)(3-32)(4-30)(5-30)(6-30)(7-31)(8-40)(9-33)(10-36)(11-42)(12-43)(13-34)(14-35)(15-41)(16-45)(17-46)(18-48)(19-31)(20-52)(21-38)(22-29)(23-37)(24-49)(25-39)(26-29)(27-29)(28-31)(29-50)(30-52)(31-52)(32-36)(32-53)(33-41)(33-53)(34-35)(34-47)(35-56)(36-40)(37-38)(37-50)(38-51)(39-49)(39-51)(40-41)(42-45)(42-54)(43-48)(43-54)(44-47)(44-55)(45-46)(46-48)(49-50)(51-52)(53-60)(54-60)(55-56)(55-60)(56-61)(57-61)(58-61)(59-61)(60-62)(61-62)

Measurements (2)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa28— 10.1016/j.dyepig.2018.11.009 2018
A549—— 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
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