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Complex #4297 — Ru(2) [C8]

2D Structure

Structure
⬇ MOL V3000

Info

ID4297
MetalRu
Oxidation state2
Charge1
Donor atoms{"N": 4}
AbbreviationC8
SMILESCOc1ccc2nc3cc(Cl)ccc3c(NCC/N=C\c3ccccn3)c2c1.Cc1ccc(C(C)C)cc1.[Cl-]

TUCAN

C32H33ClN4ORu/(1-54)(2-38)(3-35)(4-55)(5-41)(6-37)(7-35)(8-43)(9-35)(10-42)(11-56)(12-34)(13-36)(14-34)(15-36)(16-34)(17-45)(18-39)(19-36)(20-40)(21-48)(22-63)(23-63)(24-47)(25-63)(26-46)(27-58)(28-57)(29-49)(30-44)(31-57)(32-58)(33-67)(34-50)(35-54)(36-54)(37-38)(37-50)(38-51)(39-45)(39-59)(40-52)(40-64)(41-45)(41-55)(42-43)(42-50)(43-51)(44-49)(44-65)(46-61)(46-65)(47-48)(47-62)(48-64)(49-53)(51-54)(52-60)(52-62)(53-60)(53-61)(55-66)(56-59)(56-68)(57-58)(57-68)(58-67)(59-66)(60-67)(61-69)(62-69)(63-70)(64-70)(65-71)(68-72)(69-72)(70-72)

Measurements (2)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HL606.2— 10.1002/aoc.3852 2017
FG034— 10.1002/aoc.3852 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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