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Complex #1061 — Ru(2) [3]

2D Structure

Structure
⬇ MOL V3000

Info

ID1061
MetalRu
Oxidation state2
Charge0
Donor atoms{"P": 1}
Abbreviation3
SMILESC=C(CC)C(=O)c1ccc(OCC(=O)Oc2ccccc2P(c2ccccc2)c2ccccc2)c(Cl)c1Cl.Cc1ccc(C(C)C)cc1.[Cl-].[Cl-]

TUCAN

C41Cl4O4PRu/(1-25)(2-28)(3-30)(4-31)(5-28)(6-12)(6-14)(7-13)(7-30)(8-12)(8-37)(9-15)(9-22)(10-15)(10-39)(11-14)(11-37)(13-27)(16-17)(16-21)(17-38)(18-19)(18-33)(19-29)(20-26)(20-30)(21-24)(22-35)(23-24)(23-38)(25-31)(26-27)(27-28)(29-34)(29-41)(31-34)(32-36)(32-44)(33-40)(33-44)(34-42)(35-39)(35-45)(36-43)(36-45)(37-46)(38-46)(39-46)(40-41)(40-50)(41-49)

Measurements (2)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
BxPC-37.7 10.1039/c7nj02300f 2017
BALB/3T3 clone A3114 10.1039/c7nj02300f 2017

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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