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Complex #3930 — Ru(2) [3]

2D Structure

Structure
⬇ MOL V3000

Info

ID3930
MetalRu
Oxidation state2
Charge0
Donor atoms{"P": 1, "O": 2}
Abbreviation3
SMILESC1=CCC(P(c2ccccc2)c2ccccc2)CC=C1.CCOC(=O)c1ccccc1.[Cl-].[Cl-]

TUCAN

C28H29O2PRu/(1-39)(2-30)(3-31)(4-34)(5-35)(6-43)(7-53)(8-40)(9-36)(10-42)(11-37)(12-41)(13-57)(14-38)(15-45)(16-46)(17-50)(18-50)(19-44)(20-30)(21-33)(22-53)(23-32)(24-30)(25-51)(26-49)(27-51)(28-48)(29-47)(30-53)(31-32)(31-34)(32-33)(33-35)(34-52)(35-52)(36-39)(36-43)(37-41)(37-43)(38-44)(38-48)(39-55)(40-42)(40-46)(41-55)(42-50)(44-56)(45-46)(45-51)(47-48)(47-49)(49-56)(50-57)(51-57)(52-54)(53-59)(54-58)(54-59)(55-60)(56-60)(57-60)(59-61)(60-61)

Measurements (2)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa3023 10.1016/j.poly.2019.02.041 2019
RPE-17984 10.1016/j.poly.2019.02.041 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.

experimental validation surface
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