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Complex #707 — Ru(2) [3]

2D Structure

Structure
⬇ MOL V3000

Info

ID707
MetalRu
Oxidation state2
Charge0
Donor atoms{"O": 1, "N": 4}
Abbreviation3
SMILESO=C([O-])C(=O)[O-].c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1

TUCAN

C38H20N8O4Ru/(1-23)(2-29)(3-21)(4-43)(5-24)(6-41)(7-26)(8-28)(9-22)(10-25)(11-27)(12-42)(13-44)(14-32)(15-33)(16-36)(17-31)(18-30)(19-35)(20-34)(21-29)(21-43)(22-31)(22-33)(23-31)(23-53)(24-30)(24-44)(25-35)(25-54)(26-32)(26-39)(27-35)(27-36)(28-34)(28-40)(29-37)(30-38)(32-41)(33-47)(34-42)(36-51)(37-45)(37-52)(38-55)(38-56)(39-46)(39-48)(40-49)(40-50)(41-64)(42-66)(43-60)(44-62)(45-46)(45-59)(46-63)(47-53)(47-63)(48-52)(48-64)(49-55)(49-65)(50-56)(50-66)(51-54)(51-65)(52-60)(53-59)(54-61)(55-61)(56-62)(57-58)(57-67)(57-68)(58-69)(58-70)(63-71)(64-71)(65-71)(66-71)

Measurements (2)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HepG226 10.1039/d3dt04058e 2024
HepG26043 10.1039/d3dt04058e 2024

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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