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Complex #3418 — Ru(2) [3]

2D Structure

Structure
⬇ MOL V3000

Info

ID3418
MetalRu
Oxidation state2
Charge0
Donor atoms{"O": 1}
Abbreviation3
SMILESCc1ccc(C(C)C)cc1.O=C(C=C([O-])c1ccccc1)c1ccccc1.[Cl-].c1ccccc1

TUCAN

C31ClO2Ru/(1-26)(2-29)(3-29)(4-10)(4-11)(5-8)(5-9)(6-8)(6-12)(7-17)(7-21)(9-25)(10-13)(11-14)(12-25)(13-22)(14-22)(15-20)(15-26)(16-30)(16-31)(17-27)(18-19)(18-27)(19-21)(20-28)(23-24)(23-26)(24-28)(25-30)(27-31)(28-29)(30-32)(31-33)

Measurements (2)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
RPMI-822638— 10.1016/j.ica.2016.04.031 2016
U26639— 10.1016/j.ica.2016.04.031 2016

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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