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Complex #1219 — Ru(3) [3]

2D Structure

Structure
⬇ MOL V3000

Info

ID1219
MetalRu
Oxidation state3
Charge0
Donor atoms{"N": 2, "O": 1}
Abbreviation3
SMILESCOc1ccc(/C=N\CC/N=C(\C)c2ccc(O)cc2[O-])cc1.O.[Cl-].[Cl-]

TUCAN

C18H19N2O3Ru/(1-20)(2-22)(3-25)(4-34)(5-21)(6-31)(7-23)(8-31)(9-32)(10-32)(11-30)(12-34)(13-20)(14-24)(15-27)(16-20)(17-26)(18-34)(19-41)(20-33)(21-22)(21-29)(22-37)(23-25)(23-36)(24-27)(24-29)(25-28)(26-35)(26-36)(27-37)(28-33)(28-35)(29-30)(30-39)(31-32)(31-39)(32-38)(33-38)(34-42)(35-40)(36-41)(37-42)(38-43)(39-43)(42-43)

Measurements (3)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
MCF-74 10.3390/ijms17010060 2016
UACC-626.3 10.3390/ijms17010060 2016
TK-1014 10.3390/ijms17010060 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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