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Complex #886 — Ru(2) [Complex 3]

2D Structure

Structure
⬇ MOL V3000

Info

ID886
MetalRu
Oxidation state2
Charge1
Donor atoms{"N": 3, "P": 1}
AbbreviationComplex 3
SMILESON=C1c2cccnc2-c2ncccc21.c1cc[cH-]c1.c1ccc(P(c2ccccc2)c2ccccc2)cc1

TUCAN

C34H27N3OPRu/(1-28)(2-29)(3-30)(4-37)(5-35)(6-40)(7-36)(8-41)(9-42)(10-38)(11-43)(12-49)(13-34)(14-31)(15-32)(16-33)(17-48)(18-50)(19-44)(20-46)(21-39)(22-45)(23-47)(24-51)(25-54)(26-55)(27-65)(28-30)(28-59)(29-37)(29-59)(30-36)(31-32)(31-33)(32-48)(33-50)(34-49)(34-53)(35-40)(35-60)(36-37)(38-41)(38-60)(39-44)(39-61)(40-42)(41-42)(43-44)(43-46)(45-46)(45-61)(47-51)(47-52)(48-50)(49-55)(51-54)(52-56)(52-57)(53-56)(53-58)(54-62)(55-63)(56-64)(57-58)(57-62)(58-63)(59-66)(60-66)(61-66)(63-67)(64-65)(64-67)(65-67)(66-67)

Measurements (2)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
DL18 10.1016/j.jorganchem.2023.1228... 2023
PBMC2.4e+02 10.1016/j.jorganchem.2023.1228... 2023

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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