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Complex #1698 — Ru(2) [5[BF4]]

2D Structure

Structure
⬇ MOL V3000

Info

ID1698
MetalRu
Oxidation state2
Charge1
Donor atoms{"O": 1, "N": 2}
Abbreviation5[BF4]
SMILES[O-]c1ccc2ccccc2c1/C=N/c1ccc2c(c1)Cc1ccccc1-2.c1ccccc1.c1ccncc1

TUCAN

C35H27N2ORu/(1-29)(2-30)(3-28)(4-39)(5-31)(6-35)(7-42)(8-50)(9-58)(10-33)(11-32)(12-34)(13-46)(14-38)(15-37)(16-48)(17-49)(18-47)(19-44)(20-59)(21-41)(22-36)(23-45)(24-43)(25-40)(26-50)(27-60)(28-31)(28-32)(29-33)(29-58)(30-33)(30-60)(31-34)(32-46)(34-47)(35-39)(35-53)(36-40)(36-43)(37-42)(37-52)(38-39)(38-49)(40-41)(41-51)(42-61)(43-54)(44-45)(44-62)(45-54)(46-47)(48-57)(48-61)(49-56)(50-53)(50-57)(51-54)(51-55)(52-56)(52-57)(53-56)(55-59)(55-62)(58-64)(59-63)(60-64)(61-63)(62-65)(63-66)(64-66)

Measurements (3)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
T47D6.2— 10.1039/c9dt00143c 2019
MCF-715— 10.1039/c9dt00143c 2019
MCF-12A18— 10.1039/c9dt00143c 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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